7-amino-N-cyclopentyl-N-ethyl-1H-indole-2-carboxamide

C16H21N3O — CID 62057898

IUPAC7-amino-N-cyclopentyl-N-ethyl-1H-indole-2-carboxamide
SMILESCCN(C(=O)c1cc2cccc(N)c2[nH]1)C1CCCC1
InChIInChI=1S/C16H21N3O/c1-2-19(12-7-3-4-8-12)16(20)14-10-11-6-5-9-13(17)15(11)18-14/h5-6,9-10,12,18H,2-4,7-8,17H2,1H3
InChIKeyDGWMOGSLFKRWQN-UHFFFAOYSA-N
MW271.36 g/mol
LogP3.15
Rot. Bonds3

About 7-amino-N-cyclopentyl-N-ethyl-1H-indole-2-carboxamide

7-amino-N-cyclopentyl-N-ethyl-1H-indole-2-carboxamide (PubChem CID 62057898) has the molecular formula C16H21N3O and a molecular weight of 271.36 g/mol. Its IUPAC name is 7-amino-N-cyclopentyl-N-ethyl-1H-indole-2-carboxamide.

Molecular Properties

Compound Name7-amino-N-cyclopentyl-N-ethyl-1H-indole-2-carboxamide
PubChem CID62057898
Molecular FormulaC16H21N3O
Molecular Weight271.36 g/mol
Exact Mass271.17
IUPAC Name7-amino-N-cyclopentyl-N-ethyl-1H-indole-2-carboxamide
SMILESCCN(C(=O)c1cc2cccc(N)c2[nH]1)C1CCCC1
InChIInChI=1S/C16H21N3O/c1-2-19(12-7-3-4-8-12)16(20)14-10-11-6-5-9-13(17)15(11)18-14/h5-6,9-10,12,18H,2-4,7-8,17H2,1H3
InChIKeyDGWMOGSLFKRWQN-UHFFFAOYSA-N
XLogP3.15
TPSA62.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 7-amino-N-cyclopentyl-N-ethyl-1H-indole-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7-amino-N-cyclopentyl-N-ethyl-1H-indole-2-carboxamide?
The IUPAC name of 7-amino-N-cyclopentyl-N-ethyl-1H-indole-2-carboxamide (CID 62057898) is 7-amino-N-cyclopentyl-N-ethyl-1H-indole-2-carboxamide.
What is the SMILES notation for 7-amino-N-cyclopentyl-N-ethyl-1H-indole-2-carboxamide?
The canonical SMILES for 7-amino-N-cyclopentyl-N-ethyl-1H-indole-2-carboxamide is CCN(C(=O)c1cc2cccc(N)c2[nH]1)C1CCCC1.
What is the InChIKey of 7-amino-N-cyclopentyl-N-ethyl-1H-indole-2-carboxamide?
The InChIKey is DGWMOGSLFKRWQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O/c1-2-19(12-7-3-4-8-12)16(20)14-10-11-6-5-9-13(17)15(11)18-14/h5-6,9-10,12,18H,2-4,7-8,17H2,1H3.
What are the key properties of 7-amino-N-cyclopentyl-N-ethyl-1H-indole-2-carboxamide?
7-amino-N-cyclopentyl-N-ethyl-1H-indole-2-carboxamide has a molecular weight of 271.36 g/mol, XLogP of 3.15, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-N-cyclopentyl-N-ethyl-1H-indole-2-carboxamide is sourced from PubChem (CID 62057898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).