[3-(5-methylfuran-2-yl)-1-phenylpyrazol-4-yl]methanol

C15H14N2O2 — CID 882619

IUPAC[3-(5-methylfuran-2-yl)-1-phenylpyrazol-4-yl]methanol
SMILESCc1ccc(-c2nn(-c3ccccc3)cc2CO)o1
InChIInChI=1S/C15H14N2O2/c1-11-7-8-14(19-11)15-12(10-18)9-17(16-15)13-5-3-2-4-6-13/h2-9,18H,10H2,1H3
InChIKeyGZDUSCXOYLJTSO-UHFFFAOYSA-N
MW254.29 g/mol
LogP2.93
Rot. Bonds3

About [3-(5-methylfuran-2-yl)-1-phenylpyrazol-4-yl]methanol

[3-(5-methylfuran-2-yl)-1-phenylpyrazol-4-yl]methanol (PubChem CID 882619) has the molecular formula C15H14N2O2 and a molecular weight of 254.29 g/mol. Its IUPAC name is [3-(5-methylfuran-2-yl)-1-phenylpyrazol-4-yl]methanol.

Molecular Properties

Compound Name[3-(5-methylfuran-2-yl)-1-phenylpyrazol-4-yl]methanol
PubChem CID882619
Molecular FormulaC15H14N2O2
Molecular Weight254.29 g/mol
Exact Mass254.11
IUPAC Name[3-(5-methylfuran-2-yl)-1-phenylpyrazol-4-yl]methanol
SMILESCc1ccc(-c2nn(-c3ccccc3)cc2CO)o1
InChIInChI=1S/C15H14N2O2/c1-11-7-8-14(19-11)15-12(10-18)9-17(16-15)13-5-3-2-4-6-13/h2-9,18H,10H2,1H3
InChIKeyGZDUSCXOYLJTSO-UHFFFAOYSA-N
XLogP2.93
TPSA51.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [3-(5-methylfuran-2-yl)-1-phenylpyrazol-4-yl]methanol?
The IUPAC name of [3-(5-methylfuran-2-yl)-1-phenylpyrazol-4-yl]methanol (CID 882619) is [3-(5-methylfuran-2-yl)-1-phenylpyrazol-4-yl]methanol.
What is the SMILES notation for [3-(5-methylfuran-2-yl)-1-phenylpyrazol-4-yl]methanol?
The canonical SMILES for [3-(5-methylfuran-2-yl)-1-phenylpyrazol-4-yl]methanol is Cc1ccc(-c2nn(-c3ccccc3)cc2CO)o1.
What is the InChIKey of [3-(5-methylfuran-2-yl)-1-phenylpyrazol-4-yl]methanol?
The InChIKey is GZDUSCXOYLJTSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O2/c1-11-7-8-14(19-11)15-12(10-18)9-17(16-15)13-5-3-2-4-6-13/h2-9,18H,10H2,1H3.
What are the key properties of [3-(5-methylfuran-2-yl)-1-phenylpyrazol-4-yl]methanol?
[3-(5-methylfuran-2-yl)-1-phenylpyrazol-4-yl]methanol has a molecular weight of 254.29 g/mol, XLogP of 2.93, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(5-methylfuran-2-yl)-1-phenylpyrazol-4-yl]methanol is sourced from PubChem (CID 882619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).