[1-(furan-2-carbonyl)pyrazol-4-yl]-(2-hydroxyphenyl)methanone

C15H10N2O4 — CID 2537629

IUPAC[1-(furan-2-carbonyl)pyrazol-4-yl]-(2-hydroxyphenyl)methanone
SMILESO=C(c1cnn(C(=O)c2ccco2)c1)c1ccccc1O
InChIInChI=1S/C15H10N2O4/c18-12-5-2-1-4-11(12)14(19)10-8-16-17(9-10)15(20)13-6-3-7-21-13/h1-9,18H
InChIKeyATEOXPIFKMYBHO-UHFFFAOYSA-N
MW282.25 g/mol
LogP2.10
Rot. Bonds3

About [1-(furan-2-carbonyl)pyrazol-4-yl]-(2-hydroxyphenyl)methanone

[1-(furan-2-carbonyl)pyrazol-4-yl]-(2-hydroxyphenyl)methanone (PubChem CID 2537629) has the molecular formula C15H10N2O4 and a molecular weight of 282.25 g/mol. Its IUPAC name is [1-(furan-2-carbonyl)pyrazol-4-yl]-(2-hydroxyphenyl)methanone.

Molecular Properties

Compound Name[1-(furan-2-carbonyl)pyrazol-4-yl]-(2-hydroxyphenyl)methanone
PubChem CID2537629
Molecular FormulaC15H10N2O4
Molecular Weight282.25 g/mol
Exact Mass282.06
IUPAC Name[1-(furan-2-carbonyl)pyrazol-4-yl]-(2-hydroxyphenyl)methanone
SMILESO=C(c1cnn(C(=O)c2ccco2)c1)c1ccccc1O
InChIInChI=1S/C15H10N2O4/c18-12-5-2-1-4-11(12)14(19)10-8-16-17(9-10)15(20)13-6-3-7-21-13/h1-9,18H
InChIKeyATEOXPIFKMYBHO-UHFFFAOYSA-N
XLogP2.10
TPSA85.33 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.25
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

[4-(5-Fluoro-2-hydroxy-benzoyl)pyrazol-1-yl]-(2-furyl)methanone
CID 7998008
(3-methyl-1-benzofuran-2-yl)(4-methyl-1H-pyrazol-1-yl)methanone
CID 1246317
1-[4-(5-Fluoro-2-hydroxy-benzoyl)pyrazol-1-yl]-2-(2-fluorophenoxy)ethanone
CID 2116207
[4-(2-Hydroxy-5-methylbenzoyl)pyrazol-1-yl]-(4-methoxyphenyl)methanone
CID 2116213
2-(Furan-2-carbonyl)chromeno[4,3-c]pyrazol-4-one
CID 137659324
[4-(3,5-Dichloro-2-hydroxybenzoyl)pyrazol-1-yl]-(furan-2-yl)methanone
CID 4804078
2-(4-Chlorophenoxy)-1-[4-(2-hydroxy-5-methylbenzoyl)pyrazol-1-yl]ethanone
CID 2116204
2-(4-Chlorophenoxy)-1-[4-(2-hydroxybenzoyl)pyrazol-1-yl]ethanone
CID 2116206
[1-(2,5-Dimethylfuran-3-carbonyl)pyrazol-4-yl]-(2-hydroxy-5-methoxyphenyl)methanone
CID 2116215
[5-(2,4-Difluorophenyl)furan-2-yl]-pyrazol-1-ylmethanone
CID 56834430
[5-(4-Methoxyphenyl)furan-2-yl]-pyrazol-1-ylmethanone
CID 56834530
N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-3-phenylfuran-2-carboxamide
CID 31852227

Frequently Asked Questions

What is the IUPAC name of [1-(furan-2-carbonyl)pyrazol-4-yl]-(2-hydroxyphenyl)methanone?
The IUPAC name of [1-(furan-2-carbonyl)pyrazol-4-yl]-(2-hydroxyphenyl)methanone (CID 2537629) is [1-(furan-2-carbonyl)pyrazol-4-yl]-(2-hydroxyphenyl)methanone.
What is the SMILES notation for [1-(furan-2-carbonyl)pyrazol-4-yl]-(2-hydroxyphenyl)methanone?
The canonical SMILES for [1-(furan-2-carbonyl)pyrazol-4-yl]-(2-hydroxyphenyl)methanone is O=C(c1cnn(C(=O)c2ccco2)c1)c1ccccc1O.
What is the InChIKey of [1-(furan-2-carbonyl)pyrazol-4-yl]-(2-hydroxyphenyl)methanone?
The InChIKey is ATEOXPIFKMYBHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N2O4/c18-12-5-2-1-4-11(12)14(19)10-8-16-17(9-10)15(20)13-6-3-7-21-13/h1-9,18H.
What are the key properties of [1-(furan-2-carbonyl)pyrazol-4-yl]-(2-hydroxyphenyl)methanone?
[1-(furan-2-carbonyl)pyrazol-4-yl]-(2-hydroxyphenyl)methanone has a molecular weight of 282.25 g/mol, XLogP of 2.10, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(furan-2-carbonyl)pyrazol-4-yl]-(2-hydroxyphenyl)methanone is sourced from PubChem (CID 2537629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).