(2R)-2-(5-methylbenzotriazol-2-yl)-2-phenylacetamide

C15H14N4O — CID 125486531

IUPAC(2R)-2-(5-methylbenzotriazol-2-yl)-2-phenylacetamide
SMILESCc1ccc2nn([C@@H](C(N)=O)c3ccccc3)nc2c1
InChIInChI=1S/C15H14N4O/c1-10-7-8-12-13(9-10)18-19(17-12)14(15(16)20)11-5-3-2-4-6-11/h2-9,14H,1H3,(H2,16,20)/t14-/m1/s1
InChIKeyILQRXNICZWBYIK-CQSZACIVSA-N
MW266.30 g/mol
LogP1.81
Rot. Bonds3

About (2R)-2-(5-methylbenzotriazol-2-yl)-2-phenylacetamide

(2R)-2-(5-methylbenzotriazol-2-yl)-2-phenylacetamide (PubChem CID 125486531) has the molecular formula C15H14N4O and a molecular weight of 266.30 g/mol. Its IUPAC name is (2R)-2-(5-methylbenzotriazol-2-yl)-2-phenylacetamide.

Molecular Properties

Compound Name(2R)-2-(5-methylbenzotriazol-2-yl)-2-phenylacetamide
PubChem CID125486531
Molecular FormulaC15H14N4O
Molecular Weight266.30 g/mol
Exact Mass266.12
IUPAC Name(2R)-2-(5-methylbenzotriazol-2-yl)-2-phenylacetamide
SMILESCc1ccc2nn([C@@H](C(N)=O)c3ccccc3)nc2c1
InChIInChI=1S/C15H14N4O/c1-10-7-8-12-13(9-10)18-19(17-12)14(15(16)20)11-5-3-2-4-6-11/h2-9,14H,1H3,(H2,16,20)/t14-/m1/s1
InChIKeyILQRXNICZWBYIK-CQSZACIVSA-N
XLogP1.81
TPSA73.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2R)-2-(5-methylbenzotriazol-2-yl)-2-phenylacetamide 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

2-phenyl-2H-benzo[d][1,2,3]triazole-4-carboxamide
CID 44549505
2-(2H-1,2,3-benzotriazol-2-yl)-N'-[1-(4-fluorophenyl)ethylidene]acetohydrazide
CID 5454053
1-Azolyl-4-phenyl-2-butanone, 14
CID 44604203
2-(2H-1,2,3-benzotriazol-2-yl)-N'-(4-fluorobenzylidene)acetohydrazide
CID 6872983
2-(2H-1,2,3-benzotriazol-2-yl)-N'-(2-fluorobenzylidene)acetohydrazide
CID 6896911
(E)-2-(benzotriazol-2-yl)-3-phenyl-prop-2-enamide
CID 6474814
3-(1-hydroxybenzotriazol-5-yl)-4-methyl-4,5-dihydro-1H-pyridazin-6-one
CID 44714848
2-(2H-Benzotriazol-2-yl)-1-phenylethanone
CID 4638249
Benzoyl 2h benzotriazol
CID 21059132
5-Methyl-2-(5-methylbenzotriazol-2-yl)aniline
CID 164673395
2-(benzotriazol-2-yl)-N-[(4-fluorophenyl)methylideneamino]acetamide
CID 902996
2-(benzotriazol-2-yl)-N-[1-(4-fluorophenyl)ethylideneamino]acetamide
CID 1219352

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(5-methylbenzotriazol-2-yl)-2-phenylacetamide?
The IUPAC name of (2R)-2-(5-methylbenzotriazol-2-yl)-2-phenylacetamide (CID 125486531) is (2R)-2-(5-methylbenzotriazol-2-yl)-2-phenylacetamide.
What is the SMILES notation for (2R)-2-(5-methylbenzotriazol-2-yl)-2-phenylacetamide?
The canonical SMILES for (2R)-2-(5-methylbenzotriazol-2-yl)-2-phenylacetamide is Cc1ccc2nn([C@@H](C(N)=O)c3ccccc3)nc2c1.
What is the InChIKey of (2R)-2-(5-methylbenzotriazol-2-yl)-2-phenylacetamide?
The InChIKey is ILQRXNICZWBYIK-CQSZACIVSA-N. The full InChI is InChI=1S/C15H14N4O/c1-10-7-8-12-13(9-10)18-19(17-12)14(15(16)20)11-5-3-2-4-6-11/h2-9,14H,1H3,(H2,16,20)/t14-/m1/s1.
What are the key properties of (2R)-2-(5-methylbenzotriazol-2-yl)-2-phenylacetamide?
(2R)-2-(5-methylbenzotriazol-2-yl)-2-phenylacetamide has a molecular weight of 266.30 g/mol, XLogP of 1.81, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(5-methylbenzotriazol-2-yl)-2-phenylacetamide is sourced from PubChem (CID 125486531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).