2-(benzotriazol-1-yl)-N-benzylacetamide

C15H14N4O — CID 733623

IUPAC2-(benzotriazol-1-yl)-N-benzylacetamide
SMILESO=C(Cn1nnc2ccccc21)NCc1ccccc1
InChIInChI=1S/C15H14N4O/c20-15(16-10-12-6-2-1-3-7-12)11-19-14-9-5-4-8-13(14)17-18-19/h1-9H,10-11H2,(H,16,20)
InChIKeyWKNTVAQWWWRNQY-UHFFFAOYSA-N
MW266.30 g/mol
LogP1.75
Rot. Bonds4

About 2-(benzotriazol-1-yl)-N-benzylacetamide

2-(benzotriazol-1-yl)-N-benzylacetamide (PubChem CID 733623) has the molecular formula C15H14N4O and a molecular weight of 266.30 g/mol. Its IUPAC name is 2-(benzotriazol-1-yl)-N-benzylacetamide.

Molecular Properties

Compound Name2-(benzotriazol-1-yl)-N-benzylacetamide
PubChem CID733623
Molecular FormulaC15H14N4O
Molecular Weight266.30 g/mol
Exact Mass266.12
IUPAC Name2-(benzotriazol-1-yl)-N-benzylacetamide
SMILESO=C(Cn1nnc2ccccc21)NCc1ccccc1
InChIInChI=1S/C15H14N4O/c20-15(16-10-12-6-2-1-3-7-12)11-19-14-9-5-4-8-13(14)17-18-19/h1-9H,10-11H2,(H,16,20)
InChIKeyWKNTVAQWWWRNQY-UHFFFAOYSA-N
XLogP1.75
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(benzotriazol-1-yl)-N-benzylacetamide 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 2-(benzotriazol-1-yl)-N-benzylacetamide?
The IUPAC name of 2-(benzotriazol-1-yl)-N-benzylacetamide (CID 733623) is 2-(benzotriazol-1-yl)-N-benzylacetamide.
What is the SMILES notation for 2-(benzotriazol-1-yl)-N-benzylacetamide?
The canonical SMILES for 2-(benzotriazol-1-yl)-N-benzylacetamide is O=C(Cn1nnc2ccccc21)NCc1ccccc1.
What is the InChIKey of 2-(benzotriazol-1-yl)-N-benzylacetamide?
The InChIKey is WKNTVAQWWWRNQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O/c20-15(16-10-12-6-2-1-3-7-12)11-19-14-9-5-4-8-13(14)17-18-19/h1-9H,10-11H2,(H,16,20).
What are the key properties of 2-(benzotriazol-1-yl)-N-benzylacetamide?
2-(benzotriazol-1-yl)-N-benzylacetamide has a molecular weight of 266.30 g/mol, XLogP of 1.75, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzotriazol-1-yl)-N-benzylacetamide is sourced from PubChem (CID 733623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).