4-ethyl-2-phenyl-1H-indole-3-carboxamide

C17H16N2O — CID 71082978

IUPAC4-ethyl-2-phenyl-1H-indole-3-carboxamide
SMILESCCc1cccc2[nH]c(-c3ccccc3)c(C(N)=O)c12
InChIInChI=1S/C17H16N2O/c1-2-11-9-6-10-13-14(11)15(17(18)20)16(19-13)12-7-4-3-5-8-12/h3-10,19H,2H2,1H3,(H2,18,20)
InChIKeyBNDSIDQWMHUOFV-UHFFFAOYSA-N
MW264.33 g/mol
LogP3.50
Rot. Bonds3

About 4-ethyl-2-phenyl-1H-indole-3-carboxamide

4-ethyl-2-phenyl-1H-indole-3-carboxamide (PubChem CID 71082978) has the molecular formula C17H16N2O and a molecular weight of 264.33 g/mol. Its IUPAC name is 4-ethyl-2-phenyl-1H-indole-3-carboxamide.

Molecular Properties

Compound Name4-ethyl-2-phenyl-1H-indole-3-carboxamide
PubChem CID71082978
Molecular FormulaC17H16N2O
Molecular Weight264.33 g/mol
Exact Mass264.13
IUPAC Name4-ethyl-2-phenyl-1H-indole-3-carboxamide
SMILESCCc1cccc2[nH]c(-c3ccccc3)c(C(N)=O)c12
InChIInChI=1S/C17H16N2O/c1-2-11-9-6-10-13-14(11)15(17(18)20)16(19-13)12-7-4-3-5-8-12/h3-10,19H,2H2,1H3,(H2,18,20)
InChIKeyBNDSIDQWMHUOFV-UHFFFAOYSA-N
XLogP3.50
TPSA58.88 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 53.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze 4-ethyl-2-phenyl-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

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2-phenyl-1H-indole-3-carboxamide?
The IUPAC name of 4-ethyl-2-phenyl-1H-indole-3-carboxamide (CID 71082978) is 4-ethyl-2-phenyl-1H-indole-3-carboxamide.
What is the SMILES notation for 4-ethyl-2-phenyl-1H-indole-3-carboxamide?
The canonical SMILES for 4-ethyl-2-phenyl-1H-indole-3-carboxamide is CCc1cccc2[nH]c(-c3ccccc3)c(C(N)=O)c12.
What is the InChIKey of 4-ethyl-2-phenyl-1H-indole-3-carboxamide?
The InChIKey is BNDSIDQWMHUOFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O/c1-2-11-9-6-10-13-14(11)15(17(18)20)16(19-13)12-7-4-3-5-8-12/h3-10,19H,2H2,1H3,(H2,18,20).
What are the key properties of 4-ethyl-2-phenyl-1H-indole-3-carboxamide?
4-ethyl-2-phenyl-1H-indole-3-carboxamide has a molecular weight of 264.33 g/mol, XLogP of 3.50, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-phenyl-1H-indole-3-carboxamide is sourced from PubChem (CID 71082978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).