furan-2-yl-[4-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]methanone

C15H14N2O3 — CID 3159762

IUPACfuran-2-yl-[4-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]methanone
SMILESCOc1ccc(C2CNN=C2C(=O)c2ccco2)cc1
InChIInChI=1S/C15H14N2O3/c1-19-11-6-4-10(5-7-11)12-9-16-17-14(12)15(18)13-3-2-8-20-13/h2-8,12,16H,9H2,1H3
InChIKeyLHZDMPJZFROSFD-UHFFFAOYSA-N
MW270.29 g/mol
LogP2.21
Rot. Bonds4

About furan-2-yl-[4-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]methanone

furan-2-yl-[4-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]methanone (PubChem CID 3159762) has the molecular formula C15H14N2O3 and a molecular weight of 270.29 g/mol. Its IUPAC name is furan-2-yl-[4-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]methanone.

Molecular Properties

Compound Namefuran-2-yl-[4-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]methanone
PubChem CID3159762
Molecular FormulaC15H14N2O3
Molecular Weight270.29 g/mol
Exact Mass270.10
IUPAC Namefuran-2-yl-[4-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]methanone
SMILESCOc1ccc(C2CNN=C2C(=O)c2ccco2)cc1
InChIInChI=1S/C15H14N2O3/c1-19-11-6-4-10(5-7-11)12-9-16-17-14(12)15(18)13-3-2-8-20-13/h2-8,12,16H,9H2,1H3
InChIKeyLHZDMPJZFROSFD-UHFFFAOYSA-N
XLogP2.21
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of furan-2-yl-[4-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]methanone?
The IUPAC name of furan-2-yl-[4-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]methanone (CID 3159762) is furan-2-yl-[4-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]methanone.
What is the SMILES notation for furan-2-yl-[4-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]methanone?
The canonical SMILES for furan-2-yl-[4-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]methanone is COc1ccc(C2CNN=C2C(=O)c2ccco2)cc1.
What is the InChIKey of furan-2-yl-[4-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]methanone?
The InChIKey is LHZDMPJZFROSFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O3/c1-19-11-6-4-10(5-7-11)12-9-16-17-14(12)15(18)13-3-2-8-20-13/h2-8,12,16H,9H2,1H3.
What are the key properties of furan-2-yl-[4-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]methanone?
furan-2-yl-[4-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]methanone has a molecular weight of 270.29 g/mol, XLogP of 2.21, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for furan-2-yl-[4-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]methanone is sourced from PubChem (CID 3159762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).