2-methyl-3-(2-methylphenyl)-4H-quinazoline

C16H16N2 — CID 174924725

IUPAC2-methyl-3-(2-methylphenyl)-4H-quinazoline
SMILESCC1=Nc2ccccc2CN1c1ccccc1C
InChIInChI=1S/C16H16N2/c1-12-7-3-6-10-16(12)18-11-14-8-4-5-9-15(14)17-13(18)2/h3-10H,11H2,1-2H3
InChIKeyWSURTTMHIZHHNZ-UHFFFAOYSA-N
MW236.32 g/mol
LogP4.07
Rot. Bonds1

About 2-methyl-3-(2-methylphenyl)-4H-quinazoline

2-methyl-3-(2-methylphenyl)-4H-quinazoline (PubChem CID 174924725) has the molecular formula C16H16N2 and a molecular weight of 236.32 g/mol. Its IUPAC name is 2-methyl-3-(2-methylphenyl)-4H-quinazoline.

Molecular Properties

Compound Name2-methyl-3-(2-methylphenyl)-4H-quinazoline
PubChem CID174924725
Molecular FormulaC16H16N2
Molecular Weight236.32 g/mol
Exact Mass236.13
IUPAC Name2-methyl-3-(2-methylphenyl)-4H-quinazoline
SMILESCC1=Nc2ccccc2CN1c1ccccc1C
InChIInChI=1S/C16H16N2/c1-12-7-3-6-10-16(12)18-11-14-8-4-5-9-15(14)17-13(18)2/h3-10H,11H2,1-2H3
InChIKeyWSURTTMHIZHHNZ-UHFFFAOYSA-N
XLogP4.07
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 54.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-methyl-3-(2-methylphenyl)-4H-quinazoline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(2-methylphenyl)-4H-quinazoline?
The IUPAC name of 2-methyl-3-(2-methylphenyl)-4H-quinazoline (CID 174924725) is 2-methyl-3-(2-methylphenyl)-4H-quinazoline.
What is the SMILES notation for 2-methyl-3-(2-methylphenyl)-4H-quinazoline?
The canonical SMILES for 2-methyl-3-(2-methylphenyl)-4H-quinazoline is CC1=Nc2ccccc2CN1c1ccccc1C.
What is the InChIKey of 2-methyl-3-(2-methylphenyl)-4H-quinazoline?
The InChIKey is WSURTTMHIZHHNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2/c1-12-7-3-6-10-16(12)18-11-14-8-4-5-9-15(14)17-13(18)2/h3-10H,11H2,1-2H3.
What are the key properties of 2-methyl-3-(2-methylphenyl)-4H-quinazoline?
2-methyl-3-(2-methylphenyl)-4H-quinazoline has a molecular weight of 236.32 g/mol, XLogP of 4.07, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(2-methylphenyl)-4H-quinazoline is sourced from PubChem (CID 174924725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).