6-amino-N-(2-cyclohexylethyl)-1H-indole-3-carboxamide

C17H23N3O — CID 61103883

IUPAC6-amino-N-(2-cyclohexylethyl)-1H-indole-3-carboxamide
SMILESNc1ccc2c(C(=O)NCCC3CCCCC3)c[nH]c2c1
InChIInChI=1S/C17H23N3O/c18-13-6-7-14-15(11-20-16(14)10-13)17(21)19-9-8-12-4-2-1-3-5-12/h6-7,10-12,20H,1-5,8-9,18H2,(H,19,21)
InChIKeyRDAMLGCOXFTJAF-UHFFFAOYSA-N
MW285.39 g/mol
LogP3.45
Rot. Bonds4

About 6-amino-N-(2-cyclohexylethyl)-1H-indole-3-carboxamide

6-amino-N-(2-cyclohexylethyl)-1H-indole-3-carboxamide (PubChem CID 61103883) has the molecular formula C17H23N3O and a molecular weight of 285.39 g/mol. Its IUPAC name is 6-amino-N-(2-cyclohexylethyl)-1H-indole-3-carboxamide.

Molecular Properties

Compound Name6-amino-N-(2-cyclohexylethyl)-1H-indole-3-carboxamide
PubChem CID61103883
Molecular FormulaC17H23N3O
Molecular Weight285.39 g/mol
Exact Mass285.18
IUPAC Name6-amino-N-(2-cyclohexylethyl)-1H-indole-3-carboxamide
SMILESNc1ccc2c(C(=O)NCCC3CCCCC3)c[nH]c2c1
InChIInChI=1S/C17H23N3O/c18-13-6-7-14-15(11-20-16(14)10-13)17(21)19-9-8-12-4-2-1-3-5-12/h6-7,10-12,20H,1-5,8-9,18H2,(H,19,21)
InChIKeyRDAMLGCOXFTJAF-UHFFFAOYSA-N
XLogP3.45
TPSA70.91 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 53.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 6-amino-N-(2-cyclohexylethyl)-1H-indole-3-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

6-amino-N-[2-(oxolan-2-yl)ethyl]-1H-indole-3-carboxamide
CID 61126926
N-(2-cyclopentylethyl)-1H-indole-3-carboxamide
CID 47267271
6-amino-N-(3,3-dimethylbutyl)-1H-indole-3-carboxamide
CID 115597694
6-amino-N-(3-pyrrolidin-1-ylpropyl)-1H-indole-3-carboxamide
CID 61117894
6-amino-N-[2-(cyclopenten-1-yl)ethyl]-1H-indole-3-carboxamide
CID 106163847
6-amino-N-(2-phenylethyl)-1H-indole-3-carboxamide
CID 61091496
6-amino-N-(3-methoxypropyl)-1H-indole-3-carboxamide
CID 61095149
6-amino-N-[2-(2,2,2-trifluoroethoxy)ethyl]-1H-indole-3-carboxamide
CID 63824926
5-amino-N-(2-cyclohexylethyl)-1H-indole-2-carboxamide
CID 62056992
6-amino-N-(2,2-difluoroethyl)-1H-indole-3-carboxamide
CID 115405243
6-amino-N-(oxolan-3-yl)-1H-indole-3-carboxamide
CID 80717046
3,5-diamino-N-(2-cyclohexylethyl)benzamide
CID 61103497

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-(2-cyclohexylethyl)-1H-indole-3-carboxamide?
The IUPAC name of 6-amino-N-(2-cyclohexylethyl)-1H-indole-3-carboxamide (CID 61103883) is 6-amino-N-(2-cyclohexylethyl)-1H-indole-3-carboxamide.
What is the SMILES notation for 6-amino-N-(2-cyclohexylethyl)-1H-indole-3-carboxamide?
The canonical SMILES for 6-amino-N-(2-cyclohexylethyl)-1H-indole-3-carboxamide is Nc1ccc2c(C(=O)NCCC3CCCCC3)c[nH]c2c1.
What is the InChIKey of 6-amino-N-(2-cyclohexylethyl)-1H-indole-3-carboxamide?
The InChIKey is RDAMLGCOXFTJAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O/c18-13-6-7-14-15(11-20-16(14)10-13)17(21)19-9-8-12-4-2-1-3-5-12/h6-7,10-12,20H,1-5,8-9,18H2,(H,19,21).
What are the key properties of 6-amino-N-(2-cyclohexylethyl)-1H-indole-3-carboxamide?
6-amino-N-(2-cyclohexylethyl)-1H-indole-3-carboxamide has a molecular weight of 285.39 g/mol, XLogP of 3.45, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(2-cyclohexylethyl)-1H-indole-3-carboxamide is sourced from PubChem (CID 61103883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).