4-methyl-6-(3-methylphenyl)quinazolin-2-amine

C16H15N3 — CID 118084368

IUPAC4-methyl-6-(3-methylphenyl)quinazolin-2-amine
SMILESCc1cccc(-c2ccc3nc(N)nc(C)c3c2)c1
InChIInChI=1S/C16H15N3/c1-10-4-3-5-12(8-10)13-6-7-15-14(9-13)11(2)18-16(17)19-15/h3-9H,1-2H3,(H2,17,18,19)
InChIKeyKABKAPPCBVXZQG-UHFFFAOYSA-N
MW249.32 g/mol
LogP3.50
Rot. Bonds1

About 4-methyl-6-(3-methylphenyl)quinazolin-2-amine

4-methyl-6-(3-methylphenyl)quinazolin-2-amine (PubChem CID 118084368) has the molecular formula C16H15N3 and a molecular weight of 249.32 g/mol. Its IUPAC name is 4-methyl-6-(3-methylphenyl)quinazolin-2-amine.

Molecular Properties

Compound Name4-methyl-6-(3-methylphenyl)quinazolin-2-amine
PubChem CID118084368
Molecular FormulaC16H15N3
Molecular Weight249.32 g/mol
Exact Mass249.13
IUPAC Name4-methyl-6-(3-methylphenyl)quinazolin-2-amine
SMILESCc1cccc(-c2ccc3nc(N)nc(C)c3c2)c1
InChIInChI=1S/C16H15N3/c1-10-4-3-5-12(8-10)13-6-7-15-14(9-13)11(2)18-16(17)19-15/h3-9H,1-2H3,(H2,17,18,19)
InChIKeyKABKAPPCBVXZQG-UHFFFAOYSA-N
XLogP3.50
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.32
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4,6-bis(3-methylphenyl)pyrimidin-2-amine
CID 75360131
4-(3-methylphenyl)-6-phenyl-1,3,5-triazin-2-amine
CID 63866847
1-methyl-3-[4-(4-phenylphenyl)phenyl]benzene
CID 58879503
6-(3-methylphenyl)-1,3-benzothiazol-2-amine
CID 143885488
methanamine;1-methyl-3-phenylbenzene
CID 145414985
1-methyl-3-[3-[3-(4-phenylphenyl)phenyl]phenyl]benzene
CID 153438411
ethane;1-methyl-3-[4-(4-phenylphenyl)phenyl]benzene
CID 142439051
4,6,7-trimethylquinazolin-2-amine
CID 919132
6-(3-methylphenyl)quinoline
CID 4185278
9-(3-methylphenyl)-2,7-diphenylanthracene
CID 142700269
ethane;2-(3-methylphenyl)triphenylene
CID 90881937
ethane;1-methyl-3-phenylbenzene
CID 142040878

Frequently Asked Questions

What is the IUPAC name of 4-methyl-6-(3-methylphenyl)quinazolin-2-amine?
The IUPAC name of 4-methyl-6-(3-methylphenyl)quinazolin-2-amine (CID 118084368) is 4-methyl-6-(3-methylphenyl)quinazolin-2-amine.
What is the SMILES notation for 4-methyl-6-(3-methylphenyl)quinazolin-2-amine?
The canonical SMILES for 4-methyl-6-(3-methylphenyl)quinazolin-2-amine is Cc1cccc(-c2ccc3nc(N)nc(C)c3c2)c1.
What is the InChIKey of 4-methyl-6-(3-methylphenyl)quinazolin-2-amine?
The InChIKey is KABKAPPCBVXZQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3/c1-10-4-3-5-12(8-10)13-6-7-15-14(9-13)11(2)18-16(17)19-15/h3-9H,1-2H3,(H2,17,18,19).
What are the key properties of 4-methyl-6-(3-methylphenyl)quinazolin-2-amine?
4-methyl-6-(3-methylphenyl)quinazolin-2-amine has a molecular weight of 249.32 g/mol, XLogP of 3.50, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-6-(3-methylphenyl)quinazolin-2-amine is sourced from PubChem (CID 118084368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).