N-[1-(4-fluorophenyl)pyrazol-3-yl]-1-pyrimidin-2-ylcyclopropane-1-carboxamide

C17H14FN5O — CID 134596341

IUPACN-[1-(4-fluorophenyl)pyrazol-3-yl]-1-pyrimidin-2-ylcyclopropane-1-carboxamide
SMILESO=C(Nc1ccn(-c2ccc(F)cc2)n1)C1(c2ncccn2)CC1
InChIInChI=1S/C17H14FN5O/c18-12-2-4-13(5-3-12)23-11-6-14(22-23)21-16(24)17(7-8-17)15-19-9-1-10-20-15/h1-6,9-11H,7-8H2,(H,21,22,24)
InChIKeyVFLFXQQGASQXFE-UHFFFAOYSA-N
MW323.33 g/mol
LogP2.47
Rot. Bonds4

About N-[1-(4-fluorophenyl)pyrazol-3-yl]-1-pyrimidin-2-ylcyclopropane-1-carboxamide

N-[1-(4-fluorophenyl)pyrazol-3-yl]-1-pyrimidin-2-ylcyclopropane-1-carboxamide (PubChem CID 134596341) has the molecular formula C17H14FN5O and a molecular weight of 323.33 g/mol. Its IUPAC name is N-[1-(4-fluorophenyl)pyrazol-3-yl]-1-pyrimidin-2-ylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-[1-(4-fluorophenyl)pyrazol-3-yl]-1-pyrimidin-2-ylcyclopropane-1-carboxamide
PubChem CID134596341
Molecular FormulaC17H14FN5O
Molecular Weight323.33 g/mol
Exact Mass323.12
IUPAC NameN-[1-(4-fluorophenyl)pyrazol-3-yl]-1-pyrimidin-2-ylcyclopropane-1-carboxamide
SMILESO=C(Nc1ccn(-c2ccc(F)cc2)n1)C1(c2ncccn2)CC1
InChIInChI=1S/C17H14FN5O/c18-12-2-4-13(5-3-12)23-11-6-14(22-23)21-16(24)17(7-8-17)15-19-9-1-10-20-15/h1-6,9-11H,7-8H2,(H,21,22,24)
InChIKeyVFLFXQQGASQXFE-UHFFFAOYSA-N
XLogP2.47
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.33
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[1-(4-fluorophenyl)pyrazol-3-yl]-1-pyrimidin-2-ylcyclopropane-1-carboxamide 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

N-[1-(3,5-difluorophenyl)pyrazol-3-yl]-1-pyrimidin-2-ylcyclopropane-1-carboxamide
CID 134596548
1-(4-fluorophenyl)-N-(1-phenylpyrazol-3-yl)cyclopropane-1-carboxamide
CID 135315796
1-(4-fluorophenyl)-N-[1-(2-fluoro-4-pyridinyl)pyrazol-3-yl]cyclopropane-1-carboxamide
CID 134596195
N-[1-(2-fluoro-4-pyridinyl)pyrazol-3-yl]-1-phenylcyclopropane-1-carboxamide
CID 134596485
1-(2,6-difluorophenyl)-N-[1-(2-fluoro-4-pyridinyl)pyrazol-3-yl]cyclopropane-1-carboxamide
CID 135315896
N-[1-(5-fluoro-3-pyridinyl)pyrazol-3-yl]-1-phenylcyclopropane-1-carboxamide
CID 134589086
1-phenyl-N-(1-pyrimidin-5-ylpyrazol-3-yl)cyclopropane-1-carboxamide
CID 134596279
N-[1-(3,4-difluorophenyl)pyrazol-3-yl]-1-thiophen-2-ylcyclopropane-1-carboxamide
CID 134596880
1-(4-ethoxyphenyl)-N-[1-(2-fluoro-4-pyridinyl)pyrazol-3-yl]cyclopropane-1-carboxamide
CID 134596083
1-phenyl-N-(1-pyrimidin-4-ylpyrazol-3-yl)cyclopropane-1-carboxamide
CID 134589054
1-[1-(4-fluorophenyl)pyrazol-3-yl]cyclopropane-1-carboxylic acid
CID 116818347
1-(2-fluorophenyl)-N-[1-(1,3-thiazol-2-yl)pyrazol-3-yl]cyclopropane-1-carboxamide
CID 134589053

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-fluorophenyl)pyrazol-3-yl]-1-pyrimidin-2-ylcyclopropane-1-carboxamide?
The IUPAC name of N-[1-(4-fluorophenyl)pyrazol-3-yl]-1-pyrimidin-2-ylcyclopropane-1-carboxamide (CID 134596341) is N-[1-(4-fluorophenyl)pyrazol-3-yl]-1-pyrimidin-2-ylcyclopropane-1-carboxamide.
What is the SMILES notation for N-[1-(4-fluorophenyl)pyrazol-3-yl]-1-pyrimidin-2-ylcyclopropane-1-carboxamide?
The canonical SMILES for N-[1-(4-fluorophenyl)pyrazol-3-yl]-1-pyrimidin-2-ylcyclopropane-1-carboxamide is O=C(Nc1ccn(-c2ccc(F)cc2)n1)C1(c2ncccn2)CC1.
What is the InChIKey of N-[1-(4-fluorophenyl)pyrazol-3-yl]-1-pyrimidin-2-ylcyclopropane-1-carboxamide?
The InChIKey is VFLFXQQGASQXFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FN5O/c18-12-2-4-13(5-3-12)23-11-6-14(22-23)21-16(24)17(7-8-17)15-19-9-1-10-20-15/h1-6,9-11H,7-8H2,(H,21,22,24).
What are the key properties of N-[1-(4-fluorophenyl)pyrazol-3-yl]-1-pyrimidin-2-ylcyclopropane-1-carboxamide?
N-[1-(4-fluorophenyl)pyrazol-3-yl]-1-pyrimidin-2-ylcyclopropane-1-carboxamide has a molecular weight of 323.33 g/mol, XLogP of 2.47, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-fluorophenyl)pyrazol-3-yl]-1-pyrimidin-2-ylcyclopropane-1-carboxamide is sourced from PubChem (CID 134596341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).