(5-phenylfuran-2-yl)-pyrazol-1-ylmethanone

C14H10N2O2 — CID 56834432

IUPAC(5-phenylfuran-2-yl)-pyrazol-1-ylmethanone
SMILESO=C(c1ccc(-c2ccccc2)o1)n1cccn1
InChIInChI=1S/C14H10N2O2/c17-14(16-10-4-9-15-16)13-8-7-12(18-13)11-5-2-1-3-6-11/h1-10H
InChIKeyYJALQFQLYBFNTB-UHFFFAOYSA-N
MW238.25 g/mol
LogP2.83
Rot. Bonds2

About (5-phenylfuran-2-yl)-pyrazol-1-ylmethanone

(5-phenylfuran-2-yl)-pyrazol-1-ylmethanone (PubChem CID 56834432) has the molecular formula C14H10N2O2 and a molecular weight of 238.25 g/mol. Its IUPAC name is (5-phenylfuran-2-yl)-pyrazol-1-ylmethanone.

Molecular Properties

Compound Name(5-phenylfuran-2-yl)-pyrazol-1-ylmethanone
PubChem CID56834432
Molecular FormulaC14H10N2O2
Molecular Weight238.25 g/mol
Exact Mass238.07
IUPAC Name(5-phenylfuran-2-yl)-pyrazol-1-ylmethanone
SMILESO=C(c1ccc(-c2ccccc2)o1)n1cccn1
InChIInChI=1S/C14H10N2O2/c17-14(16-10-4-9-15-16)13-8-7-12(18-13)11-5-2-1-3-6-11/h1-10H
InChIKeyYJALQFQLYBFNTB-UHFFFAOYSA-N
XLogP2.83
TPSA48.03 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.25
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (5-phenylfuran-2-yl)-pyrazol-1-ylmethanone?
The IUPAC name of (5-phenylfuran-2-yl)-pyrazol-1-ylmethanone (CID 56834432) is (5-phenylfuran-2-yl)-pyrazol-1-ylmethanone.
What is the SMILES notation for (5-phenylfuran-2-yl)-pyrazol-1-ylmethanone?
The canonical SMILES for (5-phenylfuran-2-yl)-pyrazol-1-ylmethanone is O=C(c1ccc(-c2ccccc2)o1)n1cccn1.
What is the InChIKey of (5-phenylfuran-2-yl)-pyrazol-1-ylmethanone?
The InChIKey is YJALQFQLYBFNTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N2O2/c17-14(16-10-4-9-15-16)13-8-7-12(18-13)11-5-2-1-3-6-11/h1-10H.
What are the key properties of (5-phenylfuran-2-yl)-pyrazol-1-ylmethanone?
(5-phenylfuran-2-yl)-pyrazol-1-ylmethanone has a molecular weight of 238.25 g/mol, XLogP of 2.83, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-phenylfuran-2-yl)-pyrazol-1-ylmethanone is sourced from PubChem (CID 56834432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).