2-(2-methyl-1H-indol-3-yl)-N-(2-phenylethyl)acetamide

C19H20N2O — CID 31852687

IUPAC2-(2-methyl-1H-indol-3-yl)-N-(2-phenylethyl)acetamide
SMILESCc1[nH]c2ccccc2c1CC(=O)NCCc1ccccc1
InChIInChI=1S/C19H20N2O/c1-14-17(16-9-5-6-10-18(16)21-14)13-19(22)20-12-11-15-7-3-2-4-8-15/h2-10,21H,11-13H2,1H3,(H,20,22)
InChIKeyWNNZSHNRFWJUJH-UHFFFAOYSA-N
MW292.38 g/mol
LogP3.38
Rot. Bonds5

About 2-(2-methyl-1H-indol-3-yl)-N-(2-phenylethyl)acetamide

2-(2-methyl-1H-indol-3-yl)-N-(2-phenylethyl)acetamide (PubChem CID 31852687) has the molecular formula C19H20N2O and a molecular weight of 292.38 g/mol. Its IUPAC name is 2-(2-methyl-1H-indol-3-yl)-N-(2-phenylethyl)acetamide.

Molecular Properties

Compound Name2-(2-methyl-1H-indol-3-yl)-N-(2-phenylethyl)acetamide
PubChem CID31852687
Molecular FormulaC19H20N2O
Molecular Weight292.38 g/mol
Exact Mass292.16
IUPAC Name2-(2-methyl-1H-indol-3-yl)-N-(2-phenylethyl)acetamide
SMILESCc1[nH]c2ccccc2c1CC(=O)NCCc1ccccc1
InChIInChI=1S/C19H20N2O/c1-14-17(16-9-5-6-10-18(16)21-14)13-19(22)20-12-11-15-7-3-2-4-8-15/h2-10,21H,11-13H2,1H3,(H,20,22)
InChIKeyWNNZSHNRFWJUJH-UHFFFAOYSA-N
XLogP3.38
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 53.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

Analyze 2-(2-methyl-1H-indol-3-yl)-N-(2-phenylethyl)acetamide 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-(3-fluorophenyl)ethyl]-2-(2-methyl-1H-indol-3-yl)acetamide
CID 31956483
2-(5-chloro-2-methyl-1H-indol-3-yl)-N-(2-phenylethyl)acetamide
CID 113211952
2-(2-methyl-1H-indol-3-yl)ethylcarbamic acid
CID 115171128
N-[2-(2-methyl-1H-indol-3-yl)ethyl]propanamide
CID 110789052
N-[2-(2-methyl-1H-indol-3-yl)ethyl]-3-oxobutanamide
CID 71492148
2-(2-methyl-1H-indol-3-yl)-N-(2-methylprop-2-enyl)acetamide
CID 114619029
2-methyl-N-[2-(2-methyl-1H-indol-3-yl)ethyl]propanamide
CID 110789053
N-(2-aminopropyl)-2-(2-methyl-1H-indol-3-yl)acetamide
CID 110833859
N-(3-hydroxy-2-methylpropyl)-2-(2-methyl-1H-indol-3-yl)acetamide
CID 65036979
N-(2,3-dihydroxypropyl)-2-(2-methyl-1H-indol-3-yl)acetamide
CID 66175804
2-cyano-N-[2-(2-methyl-1H-indol-3-yl)ethyl]acetamide
CID 115173271
2-(ethylamino)-N-[2-(2-methyl-1H-indol-3-yl)ethyl]acetamide
CID 115158041

Frequently Asked Questions

What is the IUPAC name of 2-(2-methyl-1H-indol-3-yl)-N-(2-phenylethyl)acetamide?
The IUPAC name of 2-(2-methyl-1H-indol-3-yl)-N-(2-phenylethyl)acetamide (CID 31852687) is 2-(2-methyl-1H-indol-3-yl)-N-(2-phenylethyl)acetamide.
What is the SMILES notation for 2-(2-methyl-1H-indol-3-yl)-N-(2-phenylethyl)acetamide?
The canonical SMILES for 2-(2-methyl-1H-indol-3-yl)-N-(2-phenylethyl)acetamide is Cc1[nH]c2ccccc2c1CC(=O)NCCc1ccccc1.
What is the InChIKey of 2-(2-methyl-1H-indol-3-yl)-N-(2-phenylethyl)acetamide?
The InChIKey is WNNZSHNRFWJUJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O/c1-14-17(16-9-5-6-10-18(16)21-14)13-19(22)20-12-11-15-7-3-2-4-8-15/h2-10,21H,11-13H2,1H3,(H,20,22).
What are the key properties of 2-(2-methyl-1H-indol-3-yl)-N-(2-phenylethyl)acetamide?
2-(2-methyl-1H-indol-3-yl)-N-(2-phenylethyl)acetamide has a molecular weight of 292.38 g/mol, XLogP of 3.38, 5 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyl-1H-indol-3-yl)-N-(2-phenylethyl)acetamide is sourced from PubChem (CID 31852687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).