N-(2H-benzotriazol-5-yl)-2-(5-methyl-1H-pyrazol-3-yl)acetamide

C12H12N6O — CID 71918400

IUPACN-(2H-benzotriazol-5-yl)-2-(5-methyl-1H-pyrazol-3-yl)acetamide
SMILESCc1cc(CC(=O)Nc2ccc3n[nH]nc3c2)n[nH]1
InChIInChI=1S/C12H12N6O/c1-7-4-9(15-14-7)6-12(19)13-8-2-3-10-11(5-8)17-18-16-10/h2-5H,6H2,1H3,(H,13,19)(H,14,15)(H,16,17,18)
InChIKeyNRZJHMQIHQZNSO-UHFFFAOYSA-N
MW256.27 g/mol
LogP1.17
Rot. Bonds3

About N-(2H-benzotriazol-5-yl)-2-(5-methyl-1H-pyrazol-3-yl)acetamide

N-(2H-benzotriazol-5-yl)-2-(5-methyl-1H-pyrazol-3-yl)acetamide (PubChem CID 71918400) has the molecular formula C12H12N6O and a molecular weight of 256.27 g/mol. Its IUPAC name is N-(2H-benzotriazol-5-yl)-2-(5-methyl-1H-pyrazol-3-yl)acetamide.

Molecular Properties

Compound NameN-(2H-benzotriazol-5-yl)-2-(5-methyl-1H-pyrazol-3-yl)acetamide
PubChem CID71918400
Molecular FormulaC12H12N6O
Molecular Weight256.27 g/mol
Exact Mass256.11
IUPAC NameN-(2H-benzotriazol-5-yl)-2-(5-methyl-1H-pyrazol-3-yl)acetamide
SMILESCc1cc(CC(=O)Nc2ccc3n[nH]nc3c2)n[nH]1
InChIInChI=1S/C12H12N6O/c1-7-4-9(15-14-7)6-12(19)13-8-2-3-10-11(5-8)17-18-16-10/h2-5H,6H2,1H3,(H,13,19)(H,14,15)(H,16,17,18)
InChIKeyNRZJHMQIHQZNSO-UHFFFAOYSA-N
XLogP1.17
TPSA99.35 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.27
LogP ≤ 51.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-(2H-benzotriazol-5-yl)-2-(5-methyl-1H-pyrazol-3-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

Related Compounds

N-(3-fluorophenyl)-2-(5-methyl-1H-pyrazol-3-yl)acetamide
CID 110862703
N-[4-ethoxy-3-(hydroxymethyl)phenyl]-2-(5-methyl-1H-pyrazol-3-yl)acetamide
CID 75435747
N-[(2S)-2-ethyl-2-methyl-1,3-benzodioxol-5-yl]-2-(5-methyl-1H-pyrazol-3-yl)acetamide
CID 99637167
N-(2,4-dimethylphenyl)-2-(5-methyl-1H-pyrazol-3-yl)acetamide
CID 110857186
N-(2H-benzotriazol-5-yl)-2-cyanoacetamide
CID 168520627
2-(5-methyl-1H-pyrazol-3-yl)-N-[3-(pyrazol-1-ylmethyl)phenyl]acetamide
CID 71922145
2-(5-methyl-1H-pyrazol-3-yl)-N-(2-oxo-1-propyl-3,4-dihydroquinolin-6-yl)acetamide
CID 75441927
N-(4-chloro-2-hydroxyphenyl)-2-(5-methyl-1H-pyrazol-3-yl)acetamide
CID 75432261
N-(3-cyclobutyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-2-(5-methyl-1H-pyrazol-3-yl)acetamide
CID 126785197
propyl N-(2H-benzotriazol-5-yl)carbamate
CID 135188444
(2S)-2-amino-N-(2H-benzotriazol-5-yl)-3,3-dimethylbutanamide
CID 119706416
N-(2-aminoethyl)-2-[[2-(5-methyl-1H-pyrazol-3-yl)acetyl]amino]benzamide;hydrochloride
CID 120604073

Frequently Asked Questions

What is the IUPAC name of N-(2H-benzotriazol-5-yl)-2-(5-methyl-1H-pyrazol-3-yl)acetamide?
The IUPAC name of N-(2H-benzotriazol-5-yl)-2-(5-methyl-1H-pyrazol-3-yl)acetamide (CID 71918400) is N-(2H-benzotriazol-5-yl)-2-(5-methyl-1H-pyrazol-3-yl)acetamide.
What is the SMILES notation for N-(2H-benzotriazol-5-yl)-2-(5-methyl-1H-pyrazol-3-yl)acetamide?
The canonical SMILES for N-(2H-benzotriazol-5-yl)-2-(5-methyl-1H-pyrazol-3-yl)acetamide is Cc1cc(CC(=O)Nc2ccc3n[nH]nc3c2)n[nH]1.
What is the InChIKey of N-(2H-benzotriazol-5-yl)-2-(5-methyl-1H-pyrazol-3-yl)acetamide?
The InChIKey is NRZJHMQIHQZNSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N6O/c1-7-4-9(15-14-7)6-12(19)13-8-2-3-10-11(5-8)17-18-16-10/h2-5H,6H2,1H3,(H,13,19)(H,14,15)(H,16,17,18).
What are the key properties of N-(2H-benzotriazol-5-yl)-2-(5-methyl-1H-pyrazol-3-yl)acetamide?
N-(2H-benzotriazol-5-yl)-2-(5-methyl-1H-pyrazol-3-yl)acetamide has a molecular weight of 256.27 g/mol, XLogP of 1.17, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2H-benzotriazol-5-yl)-2-(5-methyl-1H-pyrazol-3-yl)acetamide is sourced from PubChem (CID 71918400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).