(5-benzoylfuran-2-yl)-phenylmethanone

C18H12O3 — CID 22336637

IUPAC(5-benzoylfuran-2-yl)-phenylmethanone
SMILESO=C(c1ccccc1)c1ccc(C(=O)c2ccccc2)o1
InChIInChI=1S/C18H12O3/c19-17(13-7-3-1-4-8-13)15-11-12-16(21-15)18(20)14-9-5-2-6-10-14/h1-12H
InChIKeyJDNDCWHJGDRSQI-UHFFFAOYSA-N
MW276.29 g/mol
LogP3.74
Rot. Bonds4

About (5-benzoylfuran-2-yl)-phenylmethanone

(5-benzoylfuran-2-yl)-phenylmethanone (PubChem CID 22336637) has the molecular formula C18H12O3 and a molecular weight of 276.29 g/mol. Its IUPAC name is (5-benzoylfuran-2-yl)-phenylmethanone.

Molecular Properties

Compound Name(5-benzoylfuran-2-yl)-phenylmethanone
PubChem CID22336637
Molecular FormulaC18H12O3
Molecular Weight276.29 g/mol
Exact Mass276.08
IUPAC Name(5-benzoylfuran-2-yl)-phenylmethanone
SMILESO=C(c1ccccc1)c1ccc(C(=O)c2ccccc2)o1
InChIInChI=1S/C18H12O3/c19-17(13-7-3-1-4-8-13)15-11-12-16(21-15)18(20)14-9-5-2-6-10-14/h1-12H
InChIKeyJDNDCWHJGDRSQI-UHFFFAOYSA-N
XLogP3.74
TPSA47.28 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.29
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-benzoylfuran-2-carboxylate
CID 5064810
5-benzoyl-N,N-diethylfuran-2-carboxamide
CID 692790
5-benzoyl-N-(4-hydroxyphenyl)furan-2-carboxamide
CID 777098
diphenylmethanone
CID 3102
diphenylmethanone;gold
CID 174931146
cobalt(2+);diphenylmethanone
CID 19033779
disodium;diphenylmethanone
CID 19380838
bis(diphenylmethanone);dihydrochloride
CID 69107757
bis(1,2-diphenylethane-1,2-dione);hydrogen peroxide
CID 18415505
5-(3-chlorobenzoyl)furan-2-carboxylic acid
CID 21387643
diphenylmethanone;ethane
CID 158014879
diphenylmethanone;hydron;fluoride
CID 21465824

Frequently Asked Questions

What is the IUPAC name of (5-benzoylfuran-2-yl)-phenylmethanone?
The IUPAC name of (5-benzoylfuran-2-yl)-phenylmethanone (CID 22336637) is (5-benzoylfuran-2-yl)-phenylmethanone.
What is the SMILES notation for (5-benzoylfuran-2-yl)-phenylmethanone?
The canonical SMILES for (5-benzoylfuran-2-yl)-phenylmethanone is O=C(c1ccccc1)c1ccc(C(=O)c2ccccc2)o1.
What is the InChIKey of (5-benzoylfuran-2-yl)-phenylmethanone?
The InChIKey is JDNDCWHJGDRSQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12O3/c19-17(13-7-3-1-4-8-13)15-11-12-16(21-15)18(20)14-9-5-2-6-10-14/h1-12H.
What are the key properties of (5-benzoylfuran-2-yl)-phenylmethanone?
(5-benzoylfuran-2-yl)-phenylmethanone has a molecular weight of 276.29 g/mol, XLogP of 3.74, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-benzoylfuran-2-yl)-phenylmethanone is sourced from PubChem (CID 22336637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).