N-[2-(1H-indol-3-yl)ethyl]-N-methylcyclopentanecarboxamide

C17H22N2O — CID 110733076

IUPACN-[2-(1H-indol-3-yl)ethyl]-N-methylcyclopentanecarboxamide
SMILESCN(CCc1c[nH]c2ccccc12)C(=O)C1CCCC1
InChIInChI=1S/C17H22N2O/c1-19(17(20)13-6-2-3-7-13)11-10-14-12-18-16-9-5-4-8-15(14)16/h4-5,8-9,12-13,18H,2-3,6-7,10-11H2,1H3
InChIKeySCLKSEBQTHVENK-UHFFFAOYSA-N
MW270.38 g/mol
LogP3.36
Rot. Bonds4

About N-[2-(1H-indol-3-yl)ethyl]-N-methylcyclopentanecarboxamide

N-[2-(1H-indol-3-yl)ethyl]-N-methylcyclopentanecarboxamide (PubChem CID 110733076) has the molecular formula C17H22N2O and a molecular weight of 270.38 g/mol. Its IUPAC name is N-[2-(1H-indol-3-yl)ethyl]-N-methylcyclopentanecarboxamide.

Molecular Properties

Compound NameN-[2-(1H-indol-3-yl)ethyl]-N-methylcyclopentanecarboxamide
PubChem CID110733076
Molecular FormulaC17H22N2O
Molecular Weight270.38 g/mol
Exact Mass270.17
IUPAC NameN-[2-(1H-indol-3-yl)ethyl]-N-methylcyclopentanecarboxamide
SMILESCN(CCc1c[nH]c2ccccc12)C(=O)C1CCCC1
InChIInChI=1S/C17H22N2O/c1-19(17(20)13-6-2-3-7-13)11-10-14-12-18-16-9-5-4-8-15(14)16/h4-5,8-9,12-13,18H,2-3,6-7,10-11H2,1H3
InChIKeySCLKSEBQTHVENK-UHFFFAOYSA-N
XLogP3.36
TPSA36.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-chloro-N-[2-(1H-indol-3-yl)ethyl]-N-methylacetamide
CID 82087538
1-cyclopentyl-2-(1H-indol-3-yl)ethanone
CID 126509630
N-benzyl-N-[2-[[4-(dimethylamino)phenyl]methyl-[2-(1H-indol-3-yl)ethyl]amino]-2-oxoethyl]cyclobutanecarboxamide
CID 42777131
N-[2-[(4-fluorophenyl)methyl-[2-(1H-indol-3-yl)ethyl]amino]-2-oxoethyl]-N-propylcyclohexanecarboxamide
CID 4095476
N-[2-[2-(1H-indol-3-yl)ethyl-[(4-methylphenyl)methyl]amino]-2-oxoethyl]-N-propan-2-ylcyclopentanecarboxamide
CID 42772538
5-[2-(1H-indol-3-yl)ethyl-methylamino]-5-oxopentanoic acid
CID 23336462
3-cyano-N-[2-(1H-indol-3-yl)ethyl]-N-methylpropanamide
CID 115174014
1-[2-(1H-indol-3-yl)ethyl]-1-methyl-3-propylurea
CID 110749017
N-butyl-N-[2-[(4-ethoxyphenyl)methyl-[2-(1H-indol-3-yl)ethyl]amino]-2-oxoethyl]cyclohexanecarboxamide
CID 5166385
N-[2-[2-(1H-indol-3-yl)ethyl-[(4-methylphenyl)methyl]amino]-2-oxoethyl]-N-propylcyclobutanecarboxamide
CID 4184088
N-[2-(1H-indol-3-yl)ethyl]-N-methyl-2-phenoxyacetamide
CID 110733086
N-[2-[2-(1H-indol-3-yl)ethyl-[(4-methylphenyl)methyl]amino]-2-oxoethyl]-N-(2-methoxyethyl)cyclohexanecarboxamide
CID 4601556

Frequently Asked Questions

What is the IUPAC name of N-[2-(1H-indol-3-yl)ethyl]-N-methylcyclopentanecarboxamide?
The IUPAC name of N-[2-(1H-indol-3-yl)ethyl]-N-methylcyclopentanecarboxamide (CID 110733076) is N-[2-(1H-indol-3-yl)ethyl]-N-methylcyclopentanecarboxamide.
What is the SMILES notation for N-[2-(1H-indol-3-yl)ethyl]-N-methylcyclopentanecarboxamide?
The canonical SMILES for N-[2-(1H-indol-3-yl)ethyl]-N-methylcyclopentanecarboxamide is CN(CCc1c[nH]c2ccccc12)C(=O)C1CCCC1.
What is the InChIKey of N-[2-(1H-indol-3-yl)ethyl]-N-methylcyclopentanecarboxamide?
The InChIKey is SCLKSEBQTHVENK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O/c1-19(17(20)13-6-2-3-7-13)11-10-14-12-18-16-9-5-4-8-15(14)16/h4-5,8-9,12-13,18H,2-3,6-7,10-11H2,1H3.
What are the key properties of N-[2-(1H-indol-3-yl)ethyl]-N-methylcyclopentanecarboxamide?
N-[2-(1H-indol-3-yl)ethyl]-N-methylcyclopentanecarboxamide has a molecular weight of 270.38 g/mol, XLogP of 3.36, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1H-indol-3-yl)ethyl]-N-methylcyclopentanecarboxamide is sourced from PubChem (CID 110733076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).