N-cyclopropyl-2-(difluoromethyl)pyrazole-3-carboxamide

C8H9F2N3O — CID 19506757

IUPACN-cyclopropyl-2-(difluoromethyl)pyrazole-3-carboxamide
SMILESO=C(NC1CC1)c1ccnn1C(F)F
InChIInChI=1S/C8H9F2N3O/c9-8(10)13-6(3-4-11-13)7(14)12-5-1-2-5/h3-5,8H,1-2H2,(H,12,14)
InChIKeyMQMHRVHVZHFMNZ-UHFFFAOYSA-N
MW201.18 g/mol
LogP1.17
Rot. Bonds3

About N-cyclopropyl-2-(difluoromethyl)pyrazole-3-carboxamide

N-cyclopropyl-2-(difluoromethyl)pyrazole-3-carboxamide (PubChem CID 19506757) has the molecular formula C8H9F2N3O and a molecular weight of 201.18 g/mol. Its IUPAC name is N-cyclopropyl-2-(difluoromethyl)pyrazole-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(difluoromethyl)pyrazole-3-carboxamide
PubChem CID19506757
Molecular FormulaC8H9F2N3O
Molecular Weight201.18 g/mol
Exact Mass201.07
IUPAC NameN-cyclopropyl-2-(difluoromethyl)pyrazole-3-carboxamide
SMILESO=C(NC1CC1)c1ccnn1C(F)F
InChIInChI=1S/C8H9F2N3O/c9-8(10)13-6(3-4-11-13)7(14)12-5-1-2-5/h3-5,8H,1-2H2,(H,12,14)
InChIKeyMQMHRVHVZHFMNZ-UHFFFAOYSA-N
XLogP1.17
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.18
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-cyclopropyl-2-(difluoromethyl)pyrazole-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(difluoromethyl)pyrazole-3-carboxamide?
The IUPAC name of N-cyclopropyl-2-(difluoromethyl)pyrazole-3-carboxamide (CID 19506757) is N-cyclopropyl-2-(difluoromethyl)pyrazole-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-2-(difluoromethyl)pyrazole-3-carboxamide?
The canonical SMILES for N-cyclopropyl-2-(difluoromethyl)pyrazole-3-carboxamide is O=C(NC1CC1)c1ccnn1C(F)F.
What is the InChIKey of N-cyclopropyl-2-(difluoromethyl)pyrazole-3-carboxamide?
The InChIKey is MQMHRVHVZHFMNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9F2N3O/c9-8(10)13-6(3-4-11-13)7(14)12-5-1-2-5/h3-5,8H,1-2H2,(H,12,14).
What are the key properties of N-cyclopropyl-2-(difluoromethyl)pyrazole-3-carboxamide?
N-cyclopropyl-2-(difluoromethyl)pyrazole-3-carboxamide has a molecular weight of 201.18 g/mol, XLogP of 1.17, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(difluoromethyl)pyrazole-3-carboxamide is sourced from PubChem (CID 19506757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).