N-cyclopentyl-4-methoxy-2-methyl-1H-indole-3-carboxamide

C16H20N2O2 — CID 110848681

IUPACN-cyclopentyl-4-methoxy-2-methyl-1H-indole-3-carboxamide
SMILESCOc1cccc2[nH]c(C)c(C(=O)NC3CCCC3)c12
InChIInChI=1S/C16H20N2O2/c1-10-14(16(19)18-11-6-3-4-7-11)15-12(17-10)8-5-9-13(15)20-2/h5,8-9,11,17H,3-4,6-7H2,1-2H3,(H,18,19)
InChIKeyJWCBSCAAXZNXLG-UHFFFAOYSA-N
MW272.35 g/mol
LogP3.16
Rot. Bonds3

About N-cyclopentyl-4-methoxy-2-methyl-1H-indole-3-carboxamide

N-cyclopentyl-4-methoxy-2-methyl-1H-indole-3-carboxamide (PubChem CID 110848681) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is N-cyclopentyl-4-methoxy-2-methyl-1H-indole-3-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-4-methoxy-2-methyl-1H-indole-3-carboxamide
PubChem CID110848681
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC NameN-cyclopentyl-4-methoxy-2-methyl-1H-indole-3-carboxamide
SMILESCOc1cccc2[nH]c(C)c(C(=O)NC3CCCC3)c12
InChIInChI=1S/C16H20N2O2/c1-10-14(16(19)18-11-6-3-4-7-11)15-12(17-10)8-5-9-13(15)20-2/h5,8-9,11,17H,3-4,6-7H2,1-2H3,(H,18,19)
InChIKeyJWCBSCAAXZNXLG-UHFFFAOYSA-N
XLogP3.16
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

bis(4-methoxy-2-methyl-1H-indol-3-yl)methanone
CID 143294111
N-cyclohexyl-4-methoxy-1H-indole-2-carboxamide
CID 110848909
1-(4-methoxy-2-methyl-1H-indol-3-yl)-2-methylpropan-1-one
CID 82279193
2,6-dimethoxy-N-[4-(methylamino)cyclohexyl]benzamide
CID 43653176
ethyl 4-[(2,4-dimethyl-1H-indole-3-carbonyl)amino]piperidine-1-carboxylate
CID 110853878
4-methoxy-2-methyl-N-quinolin-8-yl-1H-indole-3-carboxamide
CID 110863455
(E)-3-(4-methoxy-2-methyl-1H-indol-3-yl)but-2-enoic acid
CID 82279144
N,N-diethyl-4-methoxy-2-methyl-1H-indole-3-carboxamide
CID 110855129
2-bromo-N-cyclopropyl-6-methoxybenzamide
CID 171934573
N-cyclopentyl-2,6-diethoxybenzamide
CID 118034872
N-(azepan-4-yl)-2-fluoro-6-methoxybenzamide
CID 105059143
3,4-dihydro-1H-isoquinolin-2-yl-(4-methoxy-2-methyl-1H-indol-3-yl)methanone
CID 110852347

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-4-methoxy-2-methyl-1H-indole-3-carboxamide?
The IUPAC name of N-cyclopentyl-4-methoxy-2-methyl-1H-indole-3-carboxamide (CID 110848681) is N-cyclopentyl-4-methoxy-2-methyl-1H-indole-3-carboxamide.
What is the SMILES notation for N-cyclopentyl-4-methoxy-2-methyl-1H-indole-3-carboxamide?
The canonical SMILES for N-cyclopentyl-4-methoxy-2-methyl-1H-indole-3-carboxamide is COc1cccc2[nH]c(C)c(C(=O)NC3CCCC3)c12.
What is the InChIKey of N-cyclopentyl-4-methoxy-2-methyl-1H-indole-3-carboxamide?
The InChIKey is JWCBSCAAXZNXLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-10-14(16(19)18-11-6-3-4-7-11)15-12(17-10)8-5-9-13(15)20-2/h5,8-9,11,17H,3-4,6-7H2,1-2H3,(H,18,19).
What are the key properties of N-cyclopentyl-4-methoxy-2-methyl-1H-indole-3-carboxamide?
N-cyclopentyl-4-methoxy-2-methyl-1H-indole-3-carboxamide has a molecular weight of 272.35 g/mol, XLogP of 3.16, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-4-methoxy-2-methyl-1H-indole-3-carboxamide is sourced from PubChem (CID 110848681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).