N-[(2-methylcyclopentyl)methyl]-1H-indole-4-carboxamide

C16H20N2O — CID 107420261

IUPACN-[(2-methylcyclopentyl)methyl]-1H-indole-4-carboxamide
SMILESCC1CCCC1CNC(=O)c1cccc2[nH]ccc12
InChIInChI=1S/C16H20N2O/c1-11-4-2-5-12(11)10-18-16(19)14-6-3-7-15-13(14)8-9-17-15/h3,6-9,11-12,17H,2,4-5,10H2,1H3,(H,18,19)
InChIKeyPFDNKZJWLLXRLB-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.33
Rot. Bonds3

About N-[(2-methylcyclopentyl)methyl]-1H-indole-4-carboxamide

N-[(2-methylcyclopentyl)methyl]-1H-indole-4-carboxamide (PubChem CID 107420261) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is N-[(2-methylcyclopentyl)methyl]-1H-indole-4-carboxamide.

Molecular Properties

Compound NameN-[(2-methylcyclopentyl)methyl]-1H-indole-4-carboxamide
PubChem CID107420261
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC NameN-[(2-methylcyclopentyl)methyl]-1H-indole-4-carboxamide
SMILESCC1CCCC1CNC(=O)c1cccc2[nH]ccc12
InChIInChI=1S/C16H20N2O/c1-11-4-2-5-12(11)10-18-16(19)14-6-3-7-15-13(14)8-9-17-15/h3,6-9,11-12,17H,2,4-5,10H2,1H3,(H,18,19)
InChIKeyPFDNKZJWLLXRLB-UHFFFAOYSA-N
XLogP3.33
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 53.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

2-(methylamino)-N-[(2-methylcyclopentyl)methyl]benzamide
CID 107419522
2-(1H-indol-3-yl)-N-[(2-methylcyclopentyl)methyl]acetamide
CID 107420241
2,3-difluoro-N-[(2-methylcyclohexyl)methyl]benzamide
CID 62660422
5-amino-N-[(2-methylcyclopentyl)methyl]-1H-indole-3-carboxamide
CID 107416305
N-cyclopentyl-1H-indole-4-carboxamide
CID 43582325
N-[3-(cyclopropylamino)propyl]-1H-indole-4-carboxamide
CID 43596537
3-amino-2-chloro-N-[(2-methylcyclohexyl)methyl]benzamide
CID 112575789
2-(ethylamino)-3-fluoro-N-[(2-methylcyclopentyl)methyl]benzamide
CID 107420575
N-(3-azabicyclo[3.1.0]hexan-6-yl)-1H-indole-4-carboxamide
CID 43594493
N-(2-hydroxypropyl)-1H-indole-4-carboxamide
CID 43501200
1H-indole-4-carbohydrazide
CID 43316644
N-[(1-ethylcyclobutyl)methyl]-1H-indole-4-carboxamide
CID 103741634

Frequently Asked Questions

What is the IUPAC name of N-[(2-methylcyclopentyl)methyl]-1H-indole-4-carboxamide?
The IUPAC name of N-[(2-methylcyclopentyl)methyl]-1H-indole-4-carboxamide (CID 107420261) is N-[(2-methylcyclopentyl)methyl]-1H-indole-4-carboxamide.
What is the SMILES notation for N-[(2-methylcyclopentyl)methyl]-1H-indole-4-carboxamide?
The canonical SMILES for N-[(2-methylcyclopentyl)methyl]-1H-indole-4-carboxamide is CC1CCCC1CNC(=O)c1cccc2[nH]ccc12.
What is the InChIKey of N-[(2-methylcyclopentyl)methyl]-1H-indole-4-carboxamide?
The InChIKey is PFDNKZJWLLXRLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-11-4-2-5-12(11)10-18-16(19)14-6-3-7-15-13(14)8-9-17-15/h3,6-9,11-12,17H,2,4-5,10H2,1H3,(H,18,19).
What are the key properties of N-[(2-methylcyclopentyl)methyl]-1H-indole-4-carboxamide?
N-[(2-methylcyclopentyl)methyl]-1H-indole-4-carboxamide has a molecular weight of 256.35 g/mol, XLogP of 3.33, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylcyclopentyl)methyl]-1H-indole-4-carboxamide is sourced from PubChem (CID 107420261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).