2-methyl-4-phenyl-7,8-dihydroquinazoline

C15H14N2 — CID 135178820

IUPAC2-methyl-4-phenyl-7,8-dihydroquinazoline
SMILESCc1nc2c(c(-c3ccccc3)n1)C=CCC2
InChIInChI=1S/C15H14N2/c1-11-16-14-10-6-5-9-13(14)15(17-11)12-7-3-2-4-8-12/h2-5,7-9H,6,10H2,1H3
InChIKeyMSJGPWJQZSQYKJ-UHFFFAOYSA-N
MW222.29 g/mol
LogP3.41
Rot. Bonds1

About 2-methyl-4-phenyl-7,8-dihydroquinazoline

2-methyl-4-phenyl-7,8-dihydroquinazoline (PubChem CID 135178820) has the molecular formula C15H14N2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 2-methyl-4-phenyl-7,8-dihydroquinazoline.

Molecular Properties

Compound Name2-methyl-4-phenyl-7,8-dihydroquinazoline
PubChem CID135178820
Molecular FormulaC15H14N2
Molecular Weight222.29 g/mol
Exact Mass222.12
IUPAC Name2-methyl-4-phenyl-7,8-dihydroquinazoline
SMILESCc1nc2c(c(-c3ccccc3)n1)C=CCC2
InChIInChI=1S/C15H14N2/c1-11-16-14-10-6-5-9-13(14)15(17-11)12-7-3-2-4-8-12/h2-5,7-9H,6,10H2,1H3
InChIKeyMSJGPWJQZSQYKJ-UHFFFAOYSA-N
XLogP3.41
TPSA25.78 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 ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-phenyl-7,8-dihydroquinazoline?
The IUPAC name of 2-methyl-4-phenyl-7,8-dihydroquinazoline (CID 135178820) is 2-methyl-4-phenyl-7,8-dihydroquinazoline.
What is the SMILES notation for 2-methyl-4-phenyl-7,8-dihydroquinazoline?
The canonical SMILES for 2-methyl-4-phenyl-7,8-dihydroquinazoline is Cc1nc2c(c(-c3ccccc3)n1)C=CCC2.
What is the InChIKey of 2-methyl-4-phenyl-7,8-dihydroquinazoline?
The InChIKey is MSJGPWJQZSQYKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2/c1-11-16-14-10-6-5-9-13(14)15(17-11)12-7-3-2-4-8-12/h2-5,7-9H,6,10H2,1H3.
What are the key properties of 2-methyl-4-phenyl-7,8-dihydroquinazoline?
2-methyl-4-phenyl-7,8-dihydroquinazoline has a molecular weight of 222.29 g/mol, XLogP of 3.41, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-phenyl-7,8-dihydroquinazoline is sourced from PubChem (CID 135178820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).