N-[2-(difluoromethoxy)phenyl]-2-pyrazol-1-ylacetamide

C12H11F2N3O2 — CID 39723759

IUPACN-[2-(difluoromethoxy)phenyl]-2-pyrazol-1-ylacetamide
SMILESO=C(Cn1cccn1)Nc1ccccc1OC(F)F
InChIInChI=1S/C12H11F2N3O2/c13-12(14)19-10-5-2-1-4-9(10)16-11(18)8-17-7-3-6-15-17/h1-7,12H,8H2,(H,16,18)
InChIKeyZVILVZHRUQJPTJ-UHFFFAOYSA-N
MW267.24 g/mol
LogP2.12
Rot. Bonds5

About N-[2-(difluoromethoxy)phenyl]-2-pyrazol-1-ylacetamide

N-[2-(difluoromethoxy)phenyl]-2-pyrazol-1-ylacetamide (PubChem CID 39723759) has the molecular formula C12H11F2N3O2 and a molecular weight of 267.24 g/mol. Its IUPAC name is N-[2-(difluoromethoxy)phenyl]-2-pyrazol-1-ylacetamide.

Molecular Properties

Compound NameN-[2-(difluoromethoxy)phenyl]-2-pyrazol-1-ylacetamide
PubChem CID39723759
Molecular FormulaC12H11F2N3O2
Molecular Weight267.24 g/mol
Exact Mass267.08
IUPAC NameN-[2-(difluoromethoxy)phenyl]-2-pyrazol-1-ylacetamide
SMILESO=C(Cn1cccn1)Nc1ccccc1OC(F)F
InChIInChI=1S/C12H11F2N3O2/c13-12(14)19-10-5-2-1-4-9(10)16-11(18)8-17-7-3-6-15-17/h1-7,12H,8H2,(H,16,18)
InChIKeyZVILVZHRUQJPTJ-UHFFFAOYSA-N
XLogP2.12
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.24
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-phenylphenyl)-2-pyrazol-1-ylacetamide
CID 39723144
2-[4-[2-(butan-2-ylamino)-2-oxoethyl]piperazin-1-yl]-N-[2-(difluoromethoxy)phenyl]acetamide
CID 55565889
N-[2-(difluoromethoxy)phenyl]-3-hydroxy-3-phenylpropanamide
CID 110883082
N-[2-(difluoromethoxy)phenyl]-2-[2-(difluoromethylsulfanyl)benzimidazol-1-yl]acetamide
CID 78816234
1-[3-[2-(difluoromethoxy)anilino]-3-oxopropyl]pyrazole-3-carboxylic acid
CID 19470686
N-[2-(difluoromethoxy)phenyl]-2-(2-hydroxyphenyl)acetamide
CID 78991445
N-[2-(difluoromethoxy)phenyl]-2-(2-ethoxyphenoxy)acetamide
CID 7941491
N-[2-(difluoromethoxy)phenyl]-2-(2-fluorophenyl)sulfanylacetamide
CID 2591520
2-(3-cyano-4-methyl-2-oxo-1-pyridinyl)-N-[2-(difluoromethoxy)phenyl]acetamide
CID 75505848
2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(difluoromethoxy)phenyl]acetamide
CID 2603803
N-[2-(difluoromethoxy)phenyl]-2-(4-fluorophenyl)sulfanylacetamide
CID 2994410
N-[2-(difluoromethoxy)phenyl]-2-(2-ethoxyanilino)acetamide
CID 9102233

Frequently Asked Questions

What is the IUPAC name of N-[2-(difluoromethoxy)phenyl]-2-pyrazol-1-ylacetamide?
The IUPAC name of N-[2-(difluoromethoxy)phenyl]-2-pyrazol-1-ylacetamide (CID 39723759) is N-[2-(difluoromethoxy)phenyl]-2-pyrazol-1-ylacetamide.
What is the SMILES notation for N-[2-(difluoromethoxy)phenyl]-2-pyrazol-1-ylacetamide?
The canonical SMILES for N-[2-(difluoromethoxy)phenyl]-2-pyrazol-1-ylacetamide is O=C(Cn1cccn1)Nc1ccccc1OC(F)F.
What is the InChIKey of N-[2-(difluoromethoxy)phenyl]-2-pyrazol-1-ylacetamide?
The InChIKey is ZVILVZHRUQJPTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11F2N3O2/c13-12(14)19-10-5-2-1-4-9(10)16-11(18)8-17-7-3-6-15-17/h1-7,12H,8H2,(H,16,18).
What are the key properties of N-[2-(difluoromethoxy)phenyl]-2-pyrazol-1-ylacetamide?
N-[2-(difluoromethoxy)phenyl]-2-pyrazol-1-ylacetamide has a molecular weight of 267.24 g/mol, XLogP of 2.12, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(difluoromethoxy)phenyl]-2-pyrazol-1-ylacetamide is sourced from PubChem (CID 39723759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).