phenyl(quinazolin-4-yl)methanone

C15H10N2O — CID 10868221

IUPACphenyl(quinazolin-4-yl)methanone
SMILESO=C(c1ccccc1)c1ncnc2ccccc12
InChIInChI=1S/C15H10N2O/c18-15(11-6-2-1-3-7-11)14-12-8-4-5-9-13(12)16-10-17-14/h1-10H
InChIKeyNMJSXVGMNJYWAO-UHFFFAOYSA-N
MW234.26 g/mol
LogP2.86
Rot. Bonds2

About phenyl(quinazolin-4-yl)methanone

phenyl(quinazolin-4-yl)methanone (PubChem CID 10868221) has the molecular formula C15H10N2O and a molecular weight of 234.26 g/mol. Its IUPAC name is phenyl(quinazolin-4-yl)methanone.

Molecular Properties

Compound Namephenyl(quinazolin-4-yl)methanone
PubChem CID10868221
Molecular FormulaC15H10N2O
Molecular Weight234.26 g/mol
Exact Mass234.08
IUPAC Namephenyl(quinazolin-4-yl)methanone
SMILESO=C(c1ccccc1)c1ncnc2ccccc12
InChIInChI=1S/C15H10N2O/c18-15(11-6-2-1-3-7-11)14-12-8-4-5-9-13(12)16-10-17-14/h1-10H
InChIKeyNMJSXVGMNJYWAO-UHFFFAOYSA-N
XLogP2.86
TPSA42.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.26
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of phenyl(quinazolin-4-yl)methanone?
The IUPAC name of phenyl(quinazolin-4-yl)methanone (CID 10868221) is phenyl(quinazolin-4-yl)methanone.
What is the SMILES notation for phenyl(quinazolin-4-yl)methanone?
The canonical SMILES for phenyl(quinazolin-4-yl)methanone is O=C(c1ccccc1)c1ncnc2ccccc12.
What is the InChIKey of phenyl(quinazolin-4-yl)methanone?
The InChIKey is NMJSXVGMNJYWAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N2O/c18-15(11-6-2-1-3-7-11)14-12-8-4-5-9-13(12)16-10-17-14/h1-10H.
What are the key properties of phenyl(quinazolin-4-yl)methanone?
phenyl(quinazolin-4-yl)methanone has a molecular weight of 234.26 g/mol, XLogP of 2.86, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl(quinazolin-4-yl)methanone is sourced from PubChem (CID 10868221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).