N-[2-(4-hydroxyphenyl)ethyl]-1H-indole-3-carboxamide

C17H16N2O2 — CID 61017782

IUPACN-[2-(4-hydroxyphenyl)ethyl]-1H-indole-3-carboxamide
SMILESO=C(NCCc1ccc(O)cc1)c1c[nH]c2ccccc12
InChIInChI=1S/C17H16N2O2/c20-13-7-5-12(6-8-13)9-10-18-17(21)15-11-19-16-4-2-1-3-14(15)16/h1-8,11,19-20H,9-10H2,(H,18,21)
InChIKeyLMDMUNWVXWTGQM-UHFFFAOYSA-N
MW280.33 g/mol
LogP2.85
Rot. Bonds4

About N-[2-(4-hydroxyphenyl)ethyl]-1H-indole-3-carboxamide

N-[2-(4-hydroxyphenyl)ethyl]-1H-indole-3-carboxamide (PubChem CID 61017782) has the molecular formula C17H16N2O2 and a molecular weight of 280.33 g/mol. Its IUPAC name is N-[2-(4-hydroxyphenyl)ethyl]-1H-indole-3-carboxamide.

Molecular Properties

Compound NameN-[2-(4-hydroxyphenyl)ethyl]-1H-indole-3-carboxamide
PubChem CID61017782
Molecular FormulaC17H16N2O2
Molecular Weight280.33 g/mol
Exact Mass280.12
IUPAC NameN-[2-(4-hydroxyphenyl)ethyl]-1H-indole-3-carboxamide
SMILESO=C(NCCc1ccc(O)cc1)c1c[nH]c2ccccc12
InChIInChI=1S/C17H16N2O2/c20-13-7-5-12(6-8-13)9-10-18-17(21)15-11-19-16-4-2-1-3-14(15)16/h1-8,11,19-20H,9-10H2,(H,18,21)
InChIKeyLMDMUNWVXWTGQM-UHFFFAOYSA-N
XLogP2.85
TPSA65.12 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 52.85
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Analyze N-[2-(4-hydroxyphenyl)ethyl]-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

N-[2-(4-hydroxyphenyl)ethyl]-2-(1H-indol-3-yl)acetamide
CID 7097288
N-[2-(1-methylpyrazol-4-yl)ethyl]-1H-indole-3-carboxamide
CID 47381471
2-(1H-indol-3-yl)-2-oxo-N-(2-phenylethyl)ethanethioamide
CID 2973316
N-[2-(4-hydroxyphenyl)ethyl]-2-iodobenzamide
CID 47059383
6-amino-N-(2-phenylethyl)-1H-indole-3-carboxamide
CID 61091496
N-[2-(furan-2-carbonylamino)ethyl]-1H-indole-3-carboxamide
CID 42581260
N-[4-(2-hydroxyethyl)phenyl]-1H-indole-3-carboxamide
CID 61221955
methyl 2-(1H-indole-3-carbonylamino)acetate
CID 43406378
N-(2-phenoxyethyl)-1H-indole-3-carboxamide
CID 17447492
2-hydroxy-4-(1H-indole-3-carbonylamino)butanoic acid
CID 107831836
[2-oxo-2-(2-phenylethylamino)ethyl] 1H-indole-3-carboxylate
CID 7492818
N-(2-cyclopentylethyl)-1H-indole-3-carboxamide
CID 47267271

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-hydroxyphenyl)ethyl]-1H-indole-3-carboxamide?
The IUPAC name of N-[2-(4-hydroxyphenyl)ethyl]-1H-indole-3-carboxamide (CID 61017782) is N-[2-(4-hydroxyphenyl)ethyl]-1H-indole-3-carboxamide.
What is the SMILES notation for N-[2-(4-hydroxyphenyl)ethyl]-1H-indole-3-carboxamide?
The canonical SMILES for N-[2-(4-hydroxyphenyl)ethyl]-1H-indole-3-carboxamide is O=C(NCCc1ccc(O)cc1)c1c[nH]c2ccccc12.
What is the InChIKey of N-[2-(4-hydroxyphenyl)ethyl]-1H-indole-3-carboxamide?
The InChIKey is LMDMUNWVXWTGQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O2/c20-13-7-5-12(6-8-13)9-10-18-17(21)15-11-19-16-4-2-1-3-14(15)16/h1-8,11,19-20H,9-10H2,(H,18,21).
What are the key properties of N-[2-(4-hydroxyphenyl)ethyl]-1H-indole-3-carboxamide?
N-[2-(4-hydroxyphenyl)ethyl]-1H-indole-3-carboxamide has a molecular weight of 280.33 g/mol, XLogP of 2.85, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-hydroxyphenyl)ethyl]-1H-indole-3-carboxamide is sourced from PubChem (CID 61017782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).