N-cyclohexyl-4-(5-methoxy-1H-indol-2-yl)piperidine-1-carboxamide

C21H29N3O2 — CID 113088262

IUPACN-cyclohexyl-4-(5-methoxy-1H-indol-2-yl)piperidine-1-carboxamide
SMILESCOc1ccc2[nH]c(C3CCN(C(=O)NC4CCCCC4)CC3)cc2c1
InChIInChI=1S/C21H29N3O2/c1-26-18-7-8-19-16(13-18)14-20(23-19)15-9-11-24(12-10-15)21(25)22-17-5-3-2-4-6-17/h7-8,13-15,17,23H,2-6,9-12H2,1H3,(H,22,25)
InChIKeyZMSMPNSDTUYAOY-UHFFFAOYSA-N
MW355.48 g/mol
LogP4.40
Rot. Bonds3

About N-cyclohexyl-4-(5-methoxy-1H-indol-2-yl)piperidine-1-carboxamide

N-cyclohexyl-4-(5-methoxy-1H-indol-2-yl)piperidine-1-carboxamide (PubChem CID 113088262) has the molecular formula C21H29N3O2 and a molecular weight of 355.48 g/mol. Its IUPAC name is N-cyclohexyl-4-(5-methoxy-1H-indol-2-yl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-4-(5-methoxy-1H-indol-2-yl)piperidine-1-carboxamide
PubChem CID113088262
Molecular FormulaC21H29N3O2
Molecular Weight355.48 g/mol
Exact Mass355.23
IUPAC NameN-cyclohexyl-4-(5-methoxy-1H-indol-2-yl)piperidine-1-carboxamide
SMILESCOc1ccc2[nH]c(C3CCN(C(=O)NC4CCCCC4)CC3)cc2c1
InChIInChI=1S/C21H29N3O2/c1-26-18-7-8-19-16(13-18)14-20(23-19)15-9-11-24(12-10-15)21(25)22-17-5-3-2-4-6-17/h7-8,13-15,17,23H,2-6,9-12H2,1H3,(H,22,25)
InChIKeyZMSMPNSDTUYAOY-UHFFFAOYSA-N
XLogP4.40
TPSA57.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.48
LogP ≤ 54.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopropyl-4-(5-fluoro-1H-indol-2-yl)piperidine-1-carboxamide
CID 113088169
(3-fluorophenyl)-[4-(5-methoxy-1H-indol-2-yl)piperidin-1-yl]methanone
CID 113088227
2-(2-fluorophenyl)-1-[4-(5-methoxy-1H-indol-2-yl)piperidin-1-yl]ethanone
CID 113088256
N-cycloheptyl-4-(2,5-dimethoxyphenyl)piperazine-1-carboxamide
CID 113110606
N-(4-hydroxycyclohexyl)-3-(4-methoxyphenyl)pyrrolidine-1-carboxamide
CID 110913057
(3S)-N-cyclopentyl-3-(5-methoxy-1H-indol-3-yl)piperidine-1-carboxamide
CID 126522636
N-cyclohexyl-4-hydroxy-4-(4-methoxyphenyl)piperidine-1-carboxamide
CID 645525
N-cyclopentyl-4-[(2,5-dimethoxyphenyl)methyl]piperazine-1-carboxamide
CID 17174343
N-cycloheptyl-4-(2-methoxypyrimidin-4-yl)oxypiperidine-1-carboxamide
CID 121161621
N-cyclohexyl-4-[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]piperidine-1-carboxamide
CID 53057667
4-N-cyclohexyl-1-N-(4-methoxyphenyl)piperidine-1,4-dicarboxamide
CID 6486998
5-methoxy-2-[1-(3-methylphenyl)sulfonylpiperidin-4-yl]-1H-indole
CID 113088284

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-(5-methoxy-1H-indol-2-yl)piperidine-1-carboxamide?
The IUPAC name of N-cyclohexyl-4-(5-methoxy-1H-indol-2-yl)piperidine-1-carboxamide (CID 113088262) is N-cyclohexyl-4-(5-methoxy-1H-indol-2-yl)piperidine-1-carboxamide.
What is the SMILES notation for N-cyclohexyl-4-(5-methoxy-1H-indol-2-yl)piperidine-1-carboxamide?
The canonical SMILES for N-cyclohexyl-4-(5-methoxy-1H-indol-2-yl)piperidine-1-carboxamide is COc1ccc2[nH]c(C3CCN(C(=O)NC4CCCCC4)CC3)cc2c1.
What is the InChIKey of N-cyclohexyl-4-(5-methoxy-1H-indol-2-yl)piperidine-1-carboxamide?
The InChIKey is ZMSMPNSDTUYAOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H29N3O2/c1-26-18-7-8-19-16(13-18)14-20(23-19)15-9-11-24(12-10-15)21(25)22-17-5-3-2-4-6-17/h7-8,13-15,17,23H,2-6,9-12H2,1H3,(H,22,25).
What are the key properties of N-cyclohexyl-4-(5-methoxy-1H-indol-2-yl)piperidine-1-carboxamide?
N-cyclohexyl-4-(5-methoxy-1H-indol-2-yl)piperidine-1-carboxamide has a molecular weight of 355.48 g/mol, XLogP of 4.40, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-(5-methoxy-1H-indol-2-yl)piperidine-1-carboxamide is sourced from PubChem (CID 113088262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).