3-amino-N-[2-(1H-indol-3-yl)ethyl]cyclopentane-1-carboxamide

C16H21N3O — CID 66009623

IUPAC3-amino-N-[2-(1H-indol-3-yl)ethyl]cyclopentane-1-carboxamide
SMILESNC1CCC(C(=O)NCCc2c[nH]c3ccccc23)C1
InChIInChI=1S/C16H21N3O/c17-13-6-5-11(9-13)16(20)18-8-7-12-10-19-15-4-2-1-3-14(12)15/h1-4,10-11,13,19H,5-9,17H2,(H,18,20)
InChIKeyQYEHGSHJSWJGFY-UHFFFAOYSA-N
MW271.36 g/mol
LogP1.95
Rot. Bonds4

About 3-amino-N-[2-(1H-indol-3-yl)ethyl]cyclopentane-1-carboxamide

3-amino-N-[2-(1H-indol-3-yl)ethyl]cyclopentane-1-carboxamide (PubChem CID 66009623) has the molecular formula C16H21N3O and a molecular weight of 271.36 g/mol. Its IUPAC name is 3-amino-N-[2-(1H-indol-3-yl)ethyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-[2-(1H-indol-3-yl)ethyl]cyclopentane-1-carboxamide
PubChem CID66009623
Molecular FormulaC16H21N3O
Molecular Weight271.36 g/mol
Exact Mass271.17
IUPAC Name3-amino-N-[2-(1H-indol-3-yl)ethyl]cyclopentane-1-carboxamide
SMILESNC1CCC(C(=O)NCCc2c[nH]c3ccccc23)C1
InChIInChI=1S/C16H21N3O/c17-13-6-5-11(9-13)16(20)18-8-7-12-10-19-15-4-2-1-3-14(12)15/h1-4,10-11,13,19H,5-9,17H2,(H,18,20)
InChIKeyQYEHGSHJSWJGFY-UHFFFAOYSA-N
XLogP1.95
TPSA70.91 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 51.95
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-[3-(1H-indol-3-yl)propyl]cyclohexane-1-carboxamide
CID 119778828
4-hydroxy-N-[2-(1H-indol-3-yl)ethyl]cyclohexane-1-carboxamide
CID 112528864
4-N-cyclopentyl-1-N-[2-(1H-indol-3-yl)ethyl]cyclohexane-1,4-dicarboxamide
CID 109145805
4-N-butan-2-yl-1-N-[2-(1H-indol-3-yl)ethyl]cyclohexane-1,4-dicarboxamide
CID 109145446
N-[2-(1H-indol-3-yl)ethyl]oxane-3-carboxamide
CID 110853395
2-[2-(1H-indol-3-yl)ethylcarbamoyl]cyclopropane-1-carboxylic acid
CID 60791887
3-amino-N-[2-(2-fluorophenyl)ethyl]cyclopentane-1-carboxamide
CID 66031268
1-N-[2-(1H-indol-3-yl)ethyl]-2-N-(2-phenylethyl)cyclopropane-1,2-dicarboxamide
CID 109137338
N-[2-(1H-indol-3-yl)ethyl]-4-(4-methylpiperidine-1-carbonyl)cyclohexane-1-carboxamide
CID 109146249
1-ethylsulfonyl-N-[2-(1H-indol-3-yl)ethyl]piperidine-4-carboxamide
CID 27645744
1-N-benzyl-2-N-[2-(1H-indol-3-yl)ethyl]cyclopropane-1,2-dicarboxamide
CID 109134996
1-N-cyclopentyl-2-N-[2-(1H-indol-3-yl)ethyl]cyclopropane-1,2-dicarboxamide
CID 109132031

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[2-(1H-indol-3-yl)ethyl]cyclopentane-1-carboxamide?
The IUPAC name of 3-amino-N-[2-(1H-indol-3-yl)ethyl]cyclopentane-1-carboxamide (CID 66009623) is 3-amino-N-[2-(1H-indol-3-yl)ethyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 3-amino-N-[2-(1H-indol-3-yl)ethyl]cyclopentane-1-carboxamide?
The canonical SMILES for 3-amino-N-[2-(1H-indol-3-yl)ethyl]cyclopentane-1-carboxamide is NC1CCC(C(=O)NCCc2c[nH]c3ccccc23)C1.
What is the InChIKey of 3-amino-N-[2-(1H-indol-3-yl)ethyl]cyclopentane-1-carboxamide?
The InChIKey is QYEHGSHJSWJGFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O/c17-13-6-5-11(9-13)16(20)18-8-7-12-10-19-15-4-2-1-3-14(12)15/h1-4,10-11,13,19H,5-9,17H2,(H,18,20).
What are the key properties of 3-amino-N-[2-(1H-indol-3-yl)ethyl]cyclopentane-1-carboxamide?
3-amino-N-[2-(1H-indol-3-yl)ethyl]cyclopentane-1-carboxamide has a molecular weight of 271.36 g/mol, XLogP of 1.95, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[2-(1H-indol-3-yl)ethyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 66009623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).