N-(3-cyclopropyl-1-phenylpyrazol-5-yl)-2-fluorobenzamide

C19H16FN3O — CID 134797792

IUPACN-(3-cyclopropyl-1-phenylpyrazol-5-yl)-2-fluorobenzamide
SMILESO=C(Nc1cc(C2CC2)nn1-c1ccccc1)c1ccccc1F
InChIInChI=1S/C19H16FN3O/c20-16-9-5-4-8-15(16)19(24)21-18-12-17(13-10-11-13)22-23(18)14-6-2-1-3-7-14/h1-9,12-13H,10-11H2,(H,21,24)
InChIKeyREJUCYSFCHWGIG-UHFFFAOYSA-N
MW321.36 g/mol
LogP4.14
Rot. Bonds4

About N-(3-cyclopropyl-1-phenylpyrazol-5-yl)-2-fluorobenzamide

N-(3-cyclopropyl-1-phenylpyrazol-5-yl)-2-fluorobenzamide (PubChem CID 134797792) has the molecular formula C19H16FN3O and a molecular weight of 321.36 g/mol. Its IUPAC name is N-(3-cyclopropyl-1-phenylpyrazol-5-yl)-2-fluorobenzamide.

Molecular Properties

Compound NameN-(3-cyclopropyl-1-phenylpyrazol-5-yl)-2-fluorobenzamide
PubChem CID134797792
Molecular FormulaC19H16FN3O
Molecular Weight321.36 g/mol
Exact Mass321.13
IUPAC NameN-(3-cyclopropyl-1-phenylpyrazol-5-yl)-2-fluorobenzamide
SMILESO=C(Nc1cc(C2CC2)nn1-c1ccccc1)c1ccccc1F
InChIInChI=1S/C19H16FN3O/c20-16-9-5-4-8-15(16)19(24)21-18-12-17(13-10-11-13)22-23(18)14-6-2-1-3-7-14/h1-9,12-13H,10-11H2,(H,21,24)
InChIKeyREJUCYSFCHWGIG-UHFFFAOYSA-N
XLogP4.14
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.36
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-cyano-N-(1,3-diphenyl-1H-pyrazol-5-yl)benzamide
CID 11245456
6-methyl-2-(3-methyl-5-((4-methylphenyl)amino)-1H-pyrazol-1-yl)-1,4-dihydropyrimidin-4-one
CID 135415440
N-(1,3-diphenyl-1H-pyrazolo-5-yl)-4-nitrobenzamide
CID 11610682
N-(5-Cyclopropyl-1h-Pyrazol-3-Yl)Benzamide
CID 449088
N-(1,3-diphenyl-1H-pyrazol-5-yl)benzamide
CID 4156919
4-cyano-N-(1,3-diphenyl-1H-pyrazol-5-yl)benzamide
CID 11574130
N-(1-methyl-3-phenylpyrazol-5-yl)benzamide
CID 2814962
2-methyl-4H,5H-pyrazolo[1,5-a]quinazolin-5-one
CID 135512367
N-(5-Cyclopropyl-1h-Pyrazol-3-Yl)benzene-1,4-Dicarboxamide
CID 5330977
N-(5-cyclopropyl-1H-pyrazol-3-yl)-3-(trifluoromethyl)benzamide
CID 5330981
N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(3-fluorophenyl)phenyl]acetamide
CID 5331004
3-Phenylacetamidoaminopyrazole deriv. 39
CID 6538741

Frequently Asked Questions

What is the IUPAC name of N-(3-cyclopropyl-1-phenylpyrazol-5-yl)-2-fluorobenzamide?
The IUPAC name of N-(3-cyclopropyl-1-phenylpyrazol-5-yl)-2-fluorobenzamide (CID 134797792) is N-(3-cyclopropyl-1-phenylpyrazol-5-yl)-2-fluorobenzamide.
What is the SMILES notation for N-(3-cyclopropyl-1-phenylpyrazol-5-yl)-2-fluorobenzamide?
The canonical SMILES for N-(3-cyclopropyl-1-phenylpyrazol-5-yl)-2-fluorobenzamide is O=C(Nc1cc(C2CC2)nn1-c1ccccc1)c1ccccc1F.
What is the InChIKey of N-(3-cyclopropyl-1-phenylpyrazol-5-yl)-2-fluorobenzamide?
The InChIKey is REJUCYSFCHWGIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FN3O/c20-16-9-5-4-8-15(16)19(24)21-18-12-17(13-10-11-13)22-23(18)14-6-2-1-3-7-14/h1-9,12-13H,10-11H2,(H,21,24).
What are the key properties of N-(3-cyclopropyl-1-phenylpyrazol-5-yl)-2-fluorobenzamide?
N-(3-cyclopropyl-1-phenylpyrazol-5-yl)-2-fluorobenzamide has a molecular weight of 321.36 g/mol, XLogP of 4.14, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclopropyl-1-phenylpyrazol-5-yl)-2-fluorobenzamide is sourced from PubChem (CID 134797792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).