(2-phenylpyrazol-3-yl)-pyridin-2-ylmethanone

C15H11N3O — CID 107330077

IUPAC(2-phenylpyrazol-3-yl)-pyridin-2-ylmethanone
SMILESO=C(c1ccccn1)c1ccnn1-c1ccccc1
InChIInChI=1S/C15H11N3O/c19-15(13-8-4-5-10-16-13)14-9-11-17-18(14)12-6-2-1-3-7-12/h1-11H
InChIKeyVFMPKXZAHUANSA-UHFFFAOYSA-N
MW249.27 g/mol
LogP2.50
Rot. Bonds3

About (2-phenylpyrazol-3-yl)-pyridin-2-ylmethanone

(2-phenylpyrazol-3-yl)-pyridin-2-ylmethanone (PubChem CID 107330077) has the molecular formula C15H11N3O and a molecular weight of 249.27 g/mol. Its IUPAC name is (2-phenylpyrazol-3-yl)-pyridin-2-ylmethanone.

Molecular Properties

Compound Name(2-phenylpyrazol-3-yl)-pyridin-2-ylmethanone
PubChem CID107330077
Molecular FormulaC15H11N3O
Molecular Weight249.27 g/mol
Exact Mass249.09
IUPAC Name(2-phenylpyrazol-3-yl)-pyridin-2-ylmethanone
SMILESO=C(c1ccccn1)c1ccnn1-c1ccccc1
InChIInChI=1S/C15H11N3O/c19-15(13-8-4-5-10-16-13)14-9-11-17-18(14)12-6-2-1-3-7-12/h1-11H
InChIKeyVFMPKXZAHUANSA-UHFFFAOYSA-N
XLogP2.50
TPSA47.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.27
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(5-fluoro-2-pyridinyl)-(2-phenylpyrazol-3-yl)methanone
CID 107330183
(1-methylimidazol-4-yl)-(2-phenylpyrazol-3-yl)methanone
CID 107977650
(2-methylpyrimidin-4-yl)-(2-phenylpyrazol-3-yl)methanone
CID 107330211
(3-ethyl-2-pyridinyl)-(2-phenylpyrazol-3-yl)methanone
CID 107330218
(3,5-difluorophenyl)-(2-phenylpyrazol-3-yl)methanone
CID 107330104
(2-propylpyrazol-3-yl)-pyridin-2-ylmethanone
CID 63976118
(3,4-dichlorophenyl)-(2-phenylpyrazol-3-yl)methanone
CID 107330203
2-phenylpyrazole-3-carbothioamide
CID 83387115
(1-phenyltriazol-4-yl)-pyridin-2-ylmethanone
CID 132534234
(2,3-dimethylphenyl)-(2-phenylpyrazol-3-yl)methanone
CID 107331815
(3-iodophenyl)-(2-phenylpyrazol-3-yl)methanone
CID 107331809
(2-methylsulfanylphenyl)-(2-phenylpyrazol-3-yl)methanone
CID 107331845

Frequently Asked Questions

What is the IUPAC name of (2-phenylpyrazol-3-yl)-pyridin-2-ylmethanone?
The IUPAC name of (2-phenylpyrazol-3-yl)-pyridin-2-ylmethanone (CID 107330077) is (2-phenylpyrazol-3-yl)-pyridin-2-ylmethanone.
What is the SMILES notation for (2-phenylpyrazol-3-yl)-pyridin-2-ylmethanone?
The canonical SMILES for (2-phenylpyrazol-3-yl)-pyridin-2-ylmethanone is O=C(c1ccccn1)c1ccnn1-c1ccccc1.
What is the InChIKey of (2-phenylpyrazol-3-yl)-pyridin-2-ylmethanone?
The InChIKey is VFMPKXZAHUANSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N3O/c19-15(13-8-4-5-10-16-13)14-9-11-17-18(14)12-6-2-1-3-7-12/h1-11H.
What are the key properties of (2-phenylpyrazol-3-yl)-pyridin-2-ylmethanone?
(2-phenylpyrazol-3-yl)-pyridin-2-ylmethanone has a molecular weight of 249.27 g/mol, XLogP of 2.50, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-phenylpyrazol-3-yl)-pyridin-2-ylmethanone is sourced from PubChem (CID 107330077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).