2-[cyclopentyl(1H-indol-4-ylmethyl)amino]acetamide

C16H21N3O — CID 84593179

IUPAC2-[cyclopentyl(1H-indol-4-ylmethyl)amino]acetamide
SMILESNC(=O)CN(Cc1cccc2[nH]ccc12)C1CCCC1
InChIInChI=1S/C16H21N3O/c17-16(20)11-19(13-5-1-2-6-13)10-12-4-3-7-15-14(12)8-9-18-15/h3-4,7-9,13,18H,1-2,5-6,10-11H2,(H2,17,20)
InChIKeyJGBCAPKLJGUHGT-UHFFFAOYSA-N
MW271.36 g/mol
LogP2.40
Rot. Bonds5

About 2-[cyclopentyl(1H-indol-4-ylmethyl)amino]acetamide

2-[cyclopentyl(1H-indol-4-ylmethyl)amino]acetamide (PubChem CID 84593179) has the molecular formula C16H21N3O and a molecular weight of 271.36 g/mol. Its IUPAC name is 2-[cyclopentyl(1H-indol-4-ylmethyl)amino]acetamide.

Molecular Properties

Compound Name2-[cyclopentyl(1H-indol-4-ylmethyl)amino]acetamide
PubChem CID84593179
Molecular FormulaC16H21N3O
Molecular Weight271.36 g/mol
Exact Mass271.17
IUPAC Name2-[cyclopentyl(1H-indol-4-ylmethyl)amino]acetamide
SMILESNC(=O)CN(Cc1cccc2[nH]ccc12)C1CCCC1
InChIInChI=1S/C16H21N3O/c17-16(20)11-19(13-5-1-2-6-13)10-12-4-3-7-15-14(12)8-9-18-15/h3-4,7-9,13,18H,1-2,5-6,10-11H2,(H2,17,20)
InChIKeyJGBCAPKLJGUHGT-UHFFFAOYSA-N
XLogP2.40
TPSA62.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(3-amino-2-fluorophenyl)methyl-cyclopentylamino]acetamide
CID 107347341
2-[(3-aminophenyl)methyl-cyclohexylamino]acetamide
CID 43461239
3-[[(2-amino-2-oxoethyl)-cyclopentylamino]methyl]furan-2-carboxylic acid
CID 54988944
N-cyclopropyl-N-(1H-indol-4-ylmethyl)-3-phenylpropanamide
CID 39341773
N-cyclopropyl-N-(1H-indol-4-ylmethyl)thiophene-2-carboxamide
CID 39335113
2-[cyclopentyl-[(4-hydroxyphenyl)methyl]amino]acetamide
CID 82973746
N-(2-amino-2-oxoethyl)-N-cyclopentyl-1H-indole-3-carboxamide
CID 60958792
N-cyclobutyl-N-(3-hydroxypropyl)-1H-indole-4-carboxamide
CID 102866453
N-(2-amino-2-oxoethyl)-N-cyclopentyl-1H-indole-6-carboxamide
CID 61217148
2-[1H-indol-4-ylmethyl(2,2,2-trifluoroethyl)amino]acetic acid
CID 167857165
2-[[4-(aminomethyl)-2-methylphenyl]methyl-cyclopentylamino]acetamide
CID 114478704
2-(4-chlorophenoxy)-N-cyclopropyl-N-(1H-indol-4-ylmethyl)acetamide
CID 39338521

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl(1H-indol-4-ylmethyl)amino]acetamide?
The IUPAC name of 2-[cyclopentyl(1H-indol-4-ylmethyl)amino]acetamide (CID 84593179) is 2-[cyclopentyl(1H-indol-4-ylmethyl)amino]acetamide.
What is the SMILES notation for 2-[cyclopentyl(1H-indol-4-ylmethyl)amino]acetamide?
The canonical SMILES for 2-[cyclopentyl(1H-indol-4-ylmethyl)amino]acetamide is NC(=O)CN(Cc1cccc2[nH]ccc12)C1CCCC1.
What is the InChIKey of 2-[cyclopentyl(1H-indol-4-ylmethyl)amino]acetamide?
The InChIKey is JGBCAPKLJGUHGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O/c17-16(20)11-19(13-5-1-2-6-13)10-12-4-3-7-15-14(12)8-9-18-15/h3-4,7-9,13,18H,1-2,5-6,10-11H2,(H2,17,20).
What are the key properties of 2-[cyclopentyl(1H-indol-4-ylmethyl)amino]acetamide?
2-[cyclopentyl(1H-indol-4-ylmethyl)amino]acetamide has a molecular weight of 271.36 g/mol, XLogP of 2.40, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl(1H-indol-4-ylmethyl)amino]acetamide is sourced from PubChem (CID 84593179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).