2-(4-chlorophenyl)-N-(4-methyl-1H-pyrazol-5-yl)acetamide

C12H12ClN3O — CID 113236911

IUPAC2-(4-chlorophenyl)-N-(4-methyl-1H-pyrazol-5-yl)acetamide
SMILESCc1cn[nH]c1NC(=O)Cc1ccc(Cl)cc1
InChIInChI=1S/C12H12ClN3O/c1-8-7-14-16-12(8)15-11(17)6-9-2-4-10(13)5-3-9/h2-5,7H,6H2,1H3,(H2,14,15,16,17)
InChIKeyLFQQPNCOAJOASR-UHFFFAOYSA-N
MW249.70 g/mol
LogP2.55
Rot. Bonds3

About 2-(4-chlorophenyl)-N-(4-methyl-1H-pyrazol-5-yl)acetamide

2-(4-chlorophenyl)-N-(4-methyl-1H-pyrazol-5-yl)acetamide (PubChem CID 113236911) has the molecular formula C12H12ClN3O and a molecular weight of 249.70 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-N-(4-methyl-1H-pyrazol-5-yl)acetamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-N-(4-methyl-1H-pyrazol-5-yl)acetamide
PubChem CID113236911
Molecular FormulaC12H12ClN3O
Molecular Weight249.70 g/mol
Exact Mass249.07
IUPAC Name2-(4-chlorophenyl)-N-(4-methyl-1H-pyrazol-5-yl)acetamide
SMILESCc1cn[nH]c1NC(=O)Cc1ccc(Cl)cc1
InChIInChI=1S/C12H12ClN3O/c1-8-7-14-16-12(8)15-11(17)6-9-2-4-10(13)5-3-9/h2-5,7H,6H2,1H3,(H2,14,15,16,17)
InChIKeyLFQQPNCOAJOASR-UHFFFAOYSA-N
XLogP2.55
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.70
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(4-chlorophenyl)-N-(4-methyl-1H-pyrazol-5-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

2-(3,4-dichlorophenyl)-N-(4-methyl-1H-pyrazol-5-yl)acetamide
CID 112691199
2-(4-butylphenyl)-N-(4-methyl-1H-pyrazol-5-yl)acetamide
CID 115630203
4-chloro-N-[2-[(4-methyl-1H-pyrazol-5-yl)amino]-2-oxoethyl]benzamide
CID 115663401
N-(4-methyl-1H-pyrazol-5-yl)-2-(4-nitrophenyl)acetamide
CID 112691354
2-[4-(difluoromethoxy)phenyl]-N-(4-methyl-1H-pyrazol-5-yl)acetamide
CID 115629978
3-(2,4-dichlorophenyl)-N-(4-methyl-1H-pyrazol-5-yl)propanamide
CID 112691373
1-(4-chlorophenyl)-3-(4-methyl-1H-pyrazol-5-yl)urea
CID 113238275
2-(2,6-difluorophenyl)-N-(4-methyl-1H-pyrazol-5-yl)acetamide
CID 113253809
2-(2,4-difluorophenyl)-N-(4-methyl-1H-pyrazol-5-yl)acetamide
CID 113253808
2-[(5-chloro-2-pyridinyl)-methylamino]-N-(4-methyl-1H-pyrazol-5-yl)acetamide
CID 112691460
4-hydroxy-N-(4-methyl-1H-pyrazol-5-yl)pentanamide
CID 104621851
2-(4-chlorophenyl)-N-(4-methyl-3-pyridinyl)acetamide
CID 56826552

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-N-(4-methyl-1H-pyrazol-5-yl)acetamide?
The IUPAC name of 2-(4-chlorophenyl)-N-(4-methyl-1H-pyrazol-5-yl)acetamide (CID 113236911) is 2-(4-chlorophenyl)-N-(4-methyl-1H-pyrazol-5-yl)acetamide.
What is the SMILES notation for 2-(4-chlorophenyl)-N-(4-methyl-1H-pyrazol-5-yl)acetamide?
The canonical SMILES for 2-(4-chlorophenyl)-N-(4-methyl-1H-pyrazol-5-yl)acetamide is Cc1cn[nH]c1NC(=O)Cc1ccc(Cl)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-N-(4-methyl-1H-pyrazol-5-yl)acetamide?
The InChIKey is LFQQPNCOAJOASR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12ClN3O/c1-8-7-14-16-12(8)15-11(17)6-9-2-4-10(13)5-3-9/h2-5,7H,6H2,1H3,(H2,14,15,16,17).
What are the key properties of 2-(4-chlorophenyl)-N-(4-methyl-1H-pyrazol-5-yl)acetamide?
2-(4-chlorophenyl)-N-(4-methyl-1H-pyrazol-5-yl)acetamide has a molecular weight of 249.70 g/mol, XLogP of 2.55, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-N-(4-methyl-1H-pyrazol-5-yl)acetamide is sourced from PubChem (CID 113236911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).