N-(2-cyclohexylpyrazol-3-yl)-4-fluorobenzamide

C16H18FN3O — CID 51145829

IUPACN-(2-cyclohexylpyrazol-3-yl)-4-fluorobenzamide
SMILESO=C(Nc1ccnn1C1CCCCC1)c1ccc(F)cc1
InChIInChI=1S/C16H18FN3O/c17-13-8-6-12(7-9-13)16(21)19-15-10-11-18-20(15)14-4-2-1-3-5-14/h6-11,14H,1-5H2,(H,19,21)
InChIKeyUZWZELMAYXVJLP-UHFFFAOYSA-N
MW287.34 g/mol
LogP3.78
Rot. Bonds3

About N-(2-cyclohexylpyrazol-3-yl)-4-fluorobenzamide

N-(2-cyclohexylpyrazol-3-yl)-4-fluorobenzamide (PubChem CID 51145829) has the molecular formula C16H18FN3O and a molecular weight of 287.34 g/mol. Its IUPAC name is N-(2-cyclohexylpyrazol-3-yl)-4-fluorobenzamide.

Molecular Properties

Compound NameN-(2-cyclohexylpyrazol-3-yl)-4-fluorobenzamide
PubChem CID51145829
Molecular FormulaC16H18FN3O
Molecular Weight287.34 g/mol
Exact Mass287.14
IUPAC NameN-(2-cyclohexylpyrazol-3-yl)-4-fluorobenzamide
SMILESO=C(Nc1ccnn1C1CCCCC1)c1ccc(F)cc1
InChIInChI=1S/C16H18FN3O/c17-13-8-6-12(7-9-13)16(21)19-15-10-11-18-20(15)14-4-2-1-3-5-14/h6-11,14H,1-5H2,(H,19,21)
InChIKeyUZWZELMAYXVJLP-UHFFFAOYSA-N
XLogP3.78
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.34
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-cyclohexylpyrazol-3-yl)benzamide
CID 51145839
N-(2-cyclohexylpyrazol-3-yl)-3,4-difluorobenzamide
CID 51192351
N-(2-cyclohexylpyrazol-3-yl)-3-fluoro-4-methylbenzamide
CID 51231002
2-chloro-N-(2-cyclohexylpyrazol-3-yl)-4-fluorobenzamide
CID 51145874
2-bromo-N-(2-cyclohexylpyrazol-3-yl)-4-fluorobenzamide
CID 51205719
N-[2-(1-cyclohexylpiperidin-4-yl)pyrazol-3-yl]benzamide
CID 24794158
N-(2-cyclopentylpyrazol-3-yl)-4-imidazol-1-ylbenzamide
CID 134707115
N-(2-cyclohexylpyrazol-3-yl)-3-methylbenzamide
CID 51145870
N-(2-cyclohexylpyrazol-3-yl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide
CID 78807034
N-(2-cyclopentylpyrazol-3-yl)-3,4,5-trimethoxybenzamide
CID 8781434
3-cyano-N-(2-cyclohexylpyrazol-3-yl)benzamide
CID 51145778
N-[2-(1-cyclobutylpiperidin-4-yl)pyrazol-3-yl]-4-methoxybenzamide
CID 24816610

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexylpyrazol-3-yl)-4-fluorobenzamide?
The IUPAC name of N-(2-cyclohexylpyrazol-3-yl)-4-fluorobenzamide (CID 51145829) is N-(2-cyclohexylpyrazol-3-yl)-4-fluorobenzamide.
What is the SMILES notation for N-(2-cyclohexylpyrazol-3-yl)-4-fluorobenzamide?
The canonical SMILES for N-(2-cyclohexylpyrazol-3-yl)-4-fluorobenzamide is O=C(Nc1ccnn1C1CCCCC1)c1ccc(F)cc1.
What is the InChIKey of N-(2-cyclohexylpyrazol-3-yl)-4-fluorobenzamide?
The InChIKey is UZWZELMAYXVJLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FN3O/c17-13-8-6-12(7-9-13)16(21)19-15-10-11-18-20(15)14-4-2-1-3-5-14/h6-11,14H,1-5H2,(H,19,21).
What are the key properties of N-(2-cyclohexylpyrazol-3-yl)-4-fluorobenzamide?
N-(2-cyclohexylpyrazol-3-yl)-4-fluorobenzamide has a molecular weight of 287.34 g/mol, XLogP of 3.78, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexylpyrazol-3-yl)-4-fluorobenzamide is sourced from PubChem (CID 51145829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).