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Summary

Name:	2-{6-chloro-3-[4-(2-methoxyphenyl)piperidine-1-carbonyl]-5-methyl-1H-indol-1-yl}-N,N-dimethylacetamide
Formula:	C26 H30 Cl N3 O3
Formal charge:	0
Formula weight:	467.988 Da
Component type:	non-polymer

Chemical Identifiers

Program	Version	Name
ACDLabs	12.01	2-{6-chloro-3-[4-(2-methoxyphenyl)piperidine-1-carbonyl]-5-methyl-1H-indol-1-yl}-N,N-dimethylacetamide
OpenEye OEToolkits	2.0.7	2-[6-chloranyl-3-[4-(2-methoxyphenyl)piperidin-1-yl]carbonyl-5-methyl-indol-1-yl]-~{N},~{N}-dimethyl-ethanamide

Chemical Descriptors

Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O=C(c1cn(CC(=O)N(C)C)c2cc(Cl)c(C)cc21)N1CCC(CC1)c1ccccc1OC
InChI	InChI	1.06	InChI=1S/C26H30ClN3O3/c1-17-13-20-21(15-30(16-25(31)28(2)3)23(20)14-22(17)27)26(32)29-11-9-18(10-12-29)19-7-5-6-8-24(19)33-4/h5-8,13-15,18H,9-12,16H2,1-4H3
InChIKey	InChI	1.06	NLTMTVSREBUMDM-UHFFFAOYSA-N
SMILES_CANONICAL	CACTVS	3.385	COc1ccccc1C2CCN(CC2)C(=O)c3cn(CC(=O)N(C)C)c4cc(Cl)c(C)cc34
SMILES	CACTVS	3.385	COc1ccccc1C2CCN(CC2)C(=O)c3cn(CC(=O)N(C)C)c4cc(Cl)c(C)cc34
SMILES_CANONICAL	OpenEye OEToolkits	2.0.7	Cc1cc2c(cc1Cl)n(cc2C(=O)N3CCC(CC3)c4ccccc4OC)CC(=O)N(C)C
SMILES	OpenEye OEToolkits	2.0.7	Cc1cc2c(cc1Cl)n(cc2C(=O)N3CCC(CC3)c4ccccc4OC)CC(=O)N(C)C

250835

PDB entries from 2026-03-18

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