2-[4-(difluoromethoxy)phenyl]-N-(4-methyl-1H-pyrazol-5-yl)acetamide

C13H13F2N3O2 — CID 115629978

IUPAC2-[4-(difluoromethoxy)phenyl]-N-(4-methyl-1H-pyrazol-5-yl)acetamide
SMILESCc1cn[nH]c1NC(=O)Cc1ccc(OC(F)F)cc1
InChIInChI=1S/C13H13F2N3O2/c1-8-7-16-18-12(8)17-11(19)6-9-2-4-10(5-3-9)20-13(14)15/h2-5,7,13H,6H2,1H3,(H2,16,17,18,19)
InChIKeyGHIUFKVXYGLQNE-UHFFFAOYSA-N
MW281.26 g/mol
LogP2.50
Rot. Bonds5

About 2-[4-(difluoromethoxy)phenyl]-N-(4-methyl-1H-pyrazol-5-yl)acetamide

2-[4-(difluoromethoxy)phenyl]-N-(4-methyl-1H-pyrazol-5-yl)acetamide (PubChem CID 115629978) has the molecular formula C13H13F2N3O2 and a molecular weight of 281.26 g/mol. Its IUPAC name is 2-[4-(difluoromethoxy)phenyl]-N-(4-methyl-1H-pyrazol-5-yl)acetamide.

Molecular Properties

Compound Name2-[4-(difluoromethoxy)phenyl]-N-(4-methyl-1H-pyrazol-5-yl)acetamide
PubChem CID115629978
Molecular FormulaC13H13F2N3O2
Molecular Weight281.26 g/mol
Exact Mass281.10
IUPAC Name2-[4-(difluoromethoxy)phenyl]-N-(4-methyl-1H-pyrazol-5-yl)acetamide
SMILESCc1cn[nH]c1NC(=O)Cc1ccc(OC(F)F)cc1
InChIInChI=1S/C13H13F2N3O2/c1-8-7-16-18-12(8)17-11(19)6-9-2-4-10(5-3-9)20-13(14)15/h2-5,7,13H,6H2,1H3,(H2,16,17,18,19)
InChIKeyGHIUFKVXYGLQNE-UHFFFAOYSA-N
XLogP2.50
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.26
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[4-(difluoromethoxy)phenyl]-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-[4-(difluoromethoxy)phenyl]-N-(4-methylphenyl)acetamide
CID 33142215
2-(3,4-dichlorophenyl)-N-(4-methyl-1H-pyrazol-5-yl)acetamide
CID 112691199
N-(4-acetamidophenyl)-2-[4-(difluoromethoxy)phenyl]acetamide
CID 35049094
N-(5-chloro-2-pyridinyl)-2-[4-(difluoromethoxy)phenyl]acetamide
CID 34136582
2-[4-(difluoromethoxy)phenyl]-N-(6-methoxy-3-pyridinyl)acetamide
CID 33142873
4-hydroxy-N-(4-methyl-1H-pyrazol-5-yl)pentanamide
CID 104621851
2-[4-(difluoromethoxy)phenyl]-N-[(2-methylphenyl)methyl]acetamide
CID 33181859
2-(2,4-difluorophenyl)-N-(4-methyl-1H-pyrazol-5-yl)acetamide
CID 113253808
2-[4-(difluoromethoxy)phenyl]-N-(2-propan-2-ylpyrazol-3-yl)acetamide
CID 30183967
2-[4-(difluoromethoxy)phenyl]-N-[(2R)-2-hydroxypropyl]acetamide
CID 83031888
3-(4-methoxyphenoxy)-N-(4-methyl-1H-pyrazol-5-yl)propanamide
CID 115630345
2-[4-(difluoromethoxy)phenyl]-N-(1,3-thiazol-2-yl)acetamide
CID 33234261

Frequently Asked Questions

What is the IUPAC name of 2-[4-(difluoromethoxy)phenyl]-N-(4-methyl-1H-pyrazol-5-yl)acetamide?
The IUPAC name of 2-[4-(difluoromethoxy)phenyl]-N-(4-methyl-1H-pyrazol-5-yl)acetamide (CID 115629978) is 2-[4-(difluoromethoxy)phenyl]-N-(4-methyl-1H-pyrazol-5-yl)acetamide.
What is the SMILES notation for 2-[4-(difluoromethoxy)phenyl]-N-(4-methyl-1H-pyrazol-5-yl)acetamide?
The canonical SMILES for 2-[4-(difluoromethoxy)phenyl]-N-(4-methyl-1H-pyrazol-5-yl)acetamide is Cc1cn[nH]c1NC(=O)Cc1ccc(OC(F)F)cc1.
What is the InChIKey of 2-[4-(difluoromethoxy)phenyl]-N-(4-methyl-1H-pyrazol-5-yl)acetamide?
The InChIKey is GHIUFKVXYGLQNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13F2N3O2/c1-8-7-16-18-12(8)17-11(19)6-9-2-4-10(5-3-9)20-13(14)15/h2-5,7,13H,6H2,1H3,(H2,16,17,18,19).
What are the key properties of 2-[4-(difluoromethoxy)phenyl]-N-(4-methyl-1H-pyrazol-5-yl)acetamide?
2-[4-(difluoromethoxy)phenyl]-N-(4-methyl-1H-pyrazol-5-yl)acetamide has a molecular weight of 281.26 g/mol, XLogP of 2.50, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(difluoromethoxy)phenyl]-N-(4-methyl-1H-pyrazol-5-yl)acetamide is sourced from PubChem (CID 115629978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).