N-(2,5-difluorophenyl)pyrazole-1-carboxamide

C10H7F2N3O — CID 91805682

IUPACN-(2,5-difluorophenyl)pyrazole-1-carboxamide
SMILESO=C(Nc1cc(F)ccc1F)n1cccn1
InChIInChI=1S/C10H7F2N3O/c11-7-2-3-8(12)9(6-7)14-10(16)15-5-1-4-13-15/h1-6H,(H,14,16)
InChIKeyFWFPBGOXFMRBJK-UHFFFAOYSA-N
MW223.18 g/mol
LogP2.24
Rot. Bonds1

About N-(2,5-difluorophenyl)pyrazole-1-carboxamide

N-(2,5-difluorophenyl)pyrazole-1-carboxamide (PubChem CID 91805682) has the molecular formula C10H7F2N3O and a molecular weight of 223.18 g/mol. Its IUPAC name is N-(2,5-difluorophenyl)pyrazole-1-carboxamide.

Molecular Properties

Compound NameN-(2,5-difluorophenyl)pyrazole-1-carboxamide
PubChem CID91805682
Molecular FormulaC10H7F2N3O
Molecular Weight223.18 g/mol
Exact Mass223.06
IUPAC NameN-(2,5-difluorophenyl)pyrazole-1-carboxamide
SMILESO=C(Nc1cc(F)ccc1F)n1cccn1
InChIInChI=1S/C10H7F2N3O/c11-7-2-3-8(12)9(6-7)14-10(16)15-5-1-4-13-15/h1-6H,(H,14,16)
InChIKeyFWFPBGOXFMRBJK-UHFFFAOYSA-N
XLogP2.24
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.18
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-phenyl-N'-{4-[3-(trifluoromethyl)-1H-pyrazol-1-yl]phenyl}urea
CID 2812808
1-(2-Methylpyrazol-3-yl)-3-phenylurea
CID 2808767
N-[2-(1-phenylpyrazol-3-yl)ethyl]azetidine-1-carboxamide
CID 53594758
N-(3,4-dichlorophenyl)-3-(trifluoromethyl)pyrazole-1-carboxamide
CID 2809205
1-(1,3-Dimethylpyrazol-4-yl)-3-(4-fluorophenyl)urea
CID 2811435
N-(2,4-difluorophenyl)-N'-[1-(1,5-dimethyl-1H-pyrazol-4-yl)ethyl]urea
CID 2956297
1-(1-Methylpyrazol-3-yl)-3-phenylurea
CID 2807714
2,2,2-trifluoro-N-((1-phenyl-1H-pyrazol-3-yl)carbamoyl)acetamide
CID 1540563
N-p-fluorophenyl(1-pyrazolyl)acetamide
CID 16958290
N-(2,4-difluorophenyl)-3-(3-methyl-1H-pyrazol-1-yl)propanamide
CID 45106842
1-[1-(1,5-Dimethylpyrazol-4-yl)ethyl]-3-(2-fluorophenyl)urea
CID 45811864
1-(4-Fluorophenyl)-3-(1-pyrazol-1-ylpropan-2-yl)urea
CID 45814217

Frequently Asked Questions

What is the IUPAC name of N-(2,5-difluorophenyl)pyrazole-1-carboxamide?
The IUPAC name of N-(2,5-difluorophenyl)pyrazole-1-carboxamide (CID 91805682) is N-(2,5-difluorophenyl)pyrazole-1-carboxamide.
What is the SMILES notation for N-(2,5-difluorophenyl)pyrazole-1-carboxamide?
The canonical SMILES for N-(2,5-difluorophenyl)pyrazole-1-carboxamide is O=C(Nc1cc(F)ccc1F)n1cccn1.
What is the InChIKey of N-(2,5-difluorophenyl)pyrazole-1-carboxamide?
The InChIKey is FWFPBGOXFMRBJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7F2N3O/c11-7-2-3-8(12)9(6-7)14-10(16)15-5-1-4-13-15/h1-6H,(H,14,16).
What are the key properties of N-(2,5-difluorophenyl)pyrazole-1-carboxamide?
N-(2,5-difluorophenyl)pyrazole-1-carboxamide has a molecular weight of 223.18 g/mol, XLogP of 2.24, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-difluorophenyl)pyrazole-1-carboxamide is sourced from PubChem (CID 91805682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).