(5-fluoro-3-pyridinyl)-(1-phenylpyrazol-4-yl)methanone

C15H10FN3O — CID 105081916

IUPAC(5-fluoro-3-pyridinyl)-(1-phenylpyrazol-4-yl)methanone
SMILESO=C(c1cncc(F)c1)c1cnn(-c2ccccc2)c1
InChIInChI=1S/C15H10FN3O/c16-13-6-11(7-17-9-13)15(20)12-8-18-19(10-12)14-4-2-1-3-5-14/h1-10H
InChIKeyFNXZCXSPTKZAJR-UHFFFAOYSA-N
MW267.26 g/mol
LogP2.64
Rot. Bonds3

About (5-fluoro-3-pyridinyl)-(1-phenylpyrazol-4-yl)methanone

(5-fluoro-3-pyridinyl)-(1-phenylpyrazol-4-yl)methanone (PubChem CID 105081916) has the molecular formula C15H10FN3O and a molecular weight of 267.26 g/mol. Its IUPAC name is (5-fluoro-3-pyridinyl)-(1-phenylpyrazol-4-yl)methanone.

Molecular Properties

Compound Name(5-fluoro-3-pyridinyl)-(1-phenylpyrazol-4-yl)methanone
PubChem CID105081916
Molecular FormulaC15H10FN3O
Molecular Weight267.26 g/mol
Exact Mass267.08
IUPAC Name(5-fluoro-3-pyridinyl)-(1-phenylpyrazol-4-yl)methanone
SMILESO=C(c1cncc(F)c1)c1cnn(-c2ccccc2)c1
InChIInChI=1S/C15H10FN3O/c16-13-6-11(7-17-9-13)15(20)12-8-18-19(10-12)14-4-2-1-3-5-14/h1-10H
InChIKeyFNXZCXSPTKZAJR-UHFFFAOYSA-N
XLogP2.64
TPSA47.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.26
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(3-methylphenyl)-(1-phenylpyrazol-4-yl)methanone
CID 43340191
(1-phenylpyrazol-4-yl)-[3-(trifluoromethyl)phenyl]methanone
CID 10757758
(1-phenylpyrazol-4-yl)-(1H-pyrazol-4-yl)methanone
CID 114990512
(1-phenylpyrazol-4-yl)-thiophen-3-ylmethanone
CID 43463443
1-phenylpyrazole-4-carbonyl iodide
CID 130257311
(3-ethylphenyl)-(1-phenylpyrazol-4-yl)methanone
CID 105120280
(4-chloro-1-methylpyrazol-5-yl)-(1-phenylpyrazol-4-yl)methanone
CID 105132583
(Z)-2-fluoro-3-(1-phenylpyrazol-4-yl)but-2-enoic acid
CID 81470345
(2,5-dimethylfuran-3-yl)-(1-phenylpyrazol-4-yl)methanone
CID 43463435
4-oxo-4-(1-phenylpyrazol-4-yl)butanoic acid
CID 43322472
N,N-dimethyl-1-phenylpyrazole-4-carboxamide
CID 22103774
2,2-dimethyl-1-(1-phenylpyrazol-4-yl)propan-1-one
CID 14590777

Frequently Asked Questions

What is the IUPAC name of (5-fluoro-3-pyridinyl)-(1-phenylpyrazol-4-yl)methanone?
The IUPAC name of (5-fluoro-3-pyridinyl)-(1-phenylpyrazol-4-yl)methanone (CID 105081916) is (5-fluoro-3-pyridinyl)-(1-phenylpyrazol-4-yl)methanone.
What is the SMILES notation for (5-fluoro-3-pyridinyl)-(1-phenylpyrazol-4-yl)methanone?
The canonical SMILES for (5-fluoro-3-pyridinyl)-(1-phenylpyrazol-4-yl)methanone is O=C(c1cncc(F)c1)c1cnn(-c2ccccc2)c1.
What is the InChIKey of (5-fluoro-3-pyridinyl)-(1-phenylpyrazol-4-yl)methanone?
The InChIKey is FNXZCXSPTKZAJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10FN3O/c16-13-6-11(7-17-9-13)15(20)12-8-18-19(10-12)14-4-2-1-3-5-14/h1-10H.
What are the key properties of (5-fluoro-3-pyridinyl)-(1-phenylpyrazol-4-yl)methanone?
(5-fluoro-3-pyridinyl)-(1-phenylpyrazol-4-yl)methanone has a molecular weight of 267.26 g/mol, XLogP of 2.64, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-fluoro-3-pyridinyl)-(1-phenylpyrazol-4-yl)methanone is sourced from PubChem (CID 105081916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).