3-methyl-4-phenyl-4H-quinazoline

C15H14N2 — CID 118895473

IUPAC3-methyl-4-phenyl-4H-quinazoline
SMILESCN1C=Nc2ccccc2C1c1ccccc1
InChIInChI=1S/C15H14N2/c1-17-11-16-14-10-6-5-9-13(14)15(17)12-7-3-2-4-8-12/h2-11,15H,1H3
InChIKeyZCUDQQORDPOMGE-UHFFFAOYSA-N
MW222.29 g/mol
LogP3.38
Rot. Bonds1

About 3-methyl-4-phenyl-4H-quinazoline

3-methyl-4-phenyl-4H-quinazoline (PubChem CID 118895473) has the molecular formula C15H14N2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 3-methyl-4-phenyl-4H-quinazoline.

Molecular Properties

Compound Name3-methyl-4-phenyl-4H-quinazoline
PubChem CID118895473
Molecular FormulaC15H14N2
Molecular Weight222.29 g/mol
Exact Mass222.12
IUPAC Name3-methyl-4-phenyl-4H-quinazoline
SMILESCN1C=Nc2ccccc2C1c1ccccc1
InChIInChI=1S/C15H14N2/c1-17-11-16-14-10-6-5-9-13(14)15(17)12-7-3-2-4-8-12/h2-11,15H,1H3
InChIKeyZCUDQQORDPOMGE-UHFFFAOYSA-N
XLogP3.38
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-4-phenyl-4H-quinazoline?
The IUPAC name of 3-methyl-4-phenyl-4H-quinazoline (CID 118895473) is 3-methyl-4-phenyl-4H-quinazoline.
What is the SMILES notation for 3-methyl-4-phenyl-4H-quinazoline?
The canonical SMILES for 3-methyl-4-phenyl-4H-quinazoline is CN1C=Nc2ccccc2C1c1ccccc1.
What is the InChIKey of 3-methyl-4-phenyl-4H-quinazoline?
The InChIKey is ZCUDQQORDPOMGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2/c1-17-11-16-14-10-6-5-9-13(14)15(17)12-7-3-2-4-8-12/h2-11,15H,1H3.
What are the key properties of 3-methyl-4-phenyl-4H-quinazoline?
3-methyl-4-phenyl-4H-quinazoline has a molecular weight of 222.29 g/mol, XLogP of 3.38, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-phenyl-4H-quinazoline is sourced from PubChem (CID 118895473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).