6-methyl-N,4-diphenylquinazolin-2-amine

C21H17N3 — CID 782168

IUPAC6-methyl-N,4-diphenylquinazolin-2-amine
SMILESCc1ccc2nc(Nc3ccccc3)nc(-c3ccccc3)c2c1
InChIInChI=1S/C21H17N3/c1-15-12-13-19-18(14-15)20(16-8-4-2-5-9-16)24-21(23-19)22-17-10-6-3-7-11-17/h2-14H,1H3,(H,22,23,24)
InChIKeyLADHZYINNPRTRO-UHFFFAOYSA-N
MW311.39 g/mol
LogP5.35
Rot. Bonds3

About 6-methyl-N,4-diphenylquinazolin-2-amine

6-methyl-N,4-diphenylquinazolin-2-amine (PubChem CID 782168) has the molecular formula C21H17N3 and a molecular weight of 311.39 g/mol. Its IUPAC name is 6-methyl-N,4-diphenylquinazolin-2-amine.

Molecular Properties

Compound Name6-methyl-N,4-diphenylquinazolin-2-amine
PubChem CID782168
Molecular FormulaC21H17N3
Molecular Weight311.39 g/mol
Exact Mass311.14
IUPAC Name6-methyl-N,4-diphenylquinazolin-2-amine
SMILESCc1ccc2nc(Nc3ccccc3)nc(-c3ccccc3)c2c1
InChIInChI=1S/C21H17N3/c1-15-12-13-19-18(14-15)20(16-8-4-2-5-9-16)24-21(23-19)22-17-10-6-3-7-11-17/h2-14H,1H3,(H,22,23,24)
InChIKeyLADHZYINNPRTRO-UHFFFAOYSA-N
XLogP5.35
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500311.39
LogP ≤ 55.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-N,4-diphenylquinazolin-2-amine?
The IUPAC name of 6-methyl-N,4-diphenylquinazolin-2-amine (CID 782168) is 6-methyl-N,4-diphenylquinazolin-2-amine.
What is the SMILES notation for 6-methyl-N,4-diphenylquinazolin-2-amine?
The canonical SMILES for 6-methyl-N,4-diphenylquinazolin-2-amine is Cc1ccc2nc(Nc3ccccc3)nc(-c3ccccc3)c2c1.
What is the InChIKey of 6-methyl-N,4-diphenylquinazolin-2-amine?
The InChIKey is LADHZYINNPRTRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17N3/c1-15-12-13-19-18(14-15)20(16-8-4-2-5-9-16)24-21(23-19)22-17-10-6-3-7-11-17/h2-14H,1H3,(H,22,23,24).
What are the key properties of 6-methyl-N,4-diphenylquinazolin-2-amine?
6-methyl-N,4-diphenylquinazolin-2-amine has a molecular weight of 311.39 g/mol, XLogP of 5.35, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N,4-diphenylquinazolin-2-amine is sourced from PubChem (CID 782168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).