N-benzyl-2-(2-methylindol-1-yl)acetamide

C18H18N2O — CID 3074834

IUPACN-benzyl-2-(2-methylindol-1-yl)acetamide
SMILESCc1cc2ccccc2n1CC(=O)NCc1ccccc1
InChIInChI=1S/C18H18N2O/c1-14-11-16-9-5-6-10-17(16)20(14)13-18(21)19-12-15-7-3-2-4-8-15/h2-11H,12-13H2,1H3,(H,19,21)
InChIKeyAZFFQXYCCZNTGP-UHFFFAOYSA-N
MW278.35 g/mol
LogP3.27
Rot. Bonds4

About N-benzyl-2-(2-methylindol-1-yl)acetamide

N-benzyl-2-(2-methylindol-1-yl)acetamide (PubChem CID 3074834) has the molecular formula C18H18N2O and a molecular weight of 278.35 g/mol. Its IUPAC name is N-benzyl-2-(2-methylindol-1-yl)acetamide.

Molecular Properties

Compound NameN-benzyl-2-(2-methylindol-1-yl)acetamide
PubChem CID3074834
Molecular FormulaC18H18N2O
Molecular Weight278.35 g/mol
Exact Mass278.14
IUPAC NameN-benzyl-2-(2-methylindol-1-yl)acetamide
SMILESCc1cc2ccccc2n1CC(=O)NCc1ccccc1
InChIInChI=1S/C18H18N2O/c1-14-11-16-9-5-6-10-17(16)20(14)13-18(21)19-12-15-7-3-2-4-8-15/h2-11H,12-13H2,1H3,(H,19,21)
InChIKeyAZFFQXYCCZNTGP-UHFFFAOYSA-N
XLogP3.27
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-benzyl-2-(2-methylindol-1-yl)acetamide 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 N-benzyl-2-(2-methylindol-1-yl)acetamide?
The IUPAC name of N-benzyl-2-(2-methylindol-1-yl)acetamide (CID 3074834) is N-benzyl-2-(2-methylindol-1-yl)acetamide.
What is the SMILES notation for N-benzyl-2-(2-methylindol-1-yl)acetamide?
The canonical SMILES for N-benzyl-2-(2-methylindol-1-yl)acetamide is Cc1cc2ccccc2n1CC(=O)NCc1ccccc1.
What is the InChIKey of N-benzyl-2-(2-methylindol-1-yl)acetamide?
The InChIKey is AZFFQXYCCZNTGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O/c1-14-11-16-9-5-6-10-17(16)20(14)13-18(21)19-12-15-7-3-2-4-8-15/h2-11H,12-13H2,1H3,(H,19,21).
What are the key properties of N-benzyl-2-(2-methylindol-1-yl)acetamide?
N-benzyl-2-(2-methylindol-1-yl)acetamide has a molecular weight of 278.35 g/mol, XLogP of 3.27, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-(2-methylindol-1-yl)acetamide is sourced from PubChem (CID 3074834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).