2,4-dimethyl-N-phenylquinazolin-7-amine

C16H15N3 — CID 175557011

IUPAC2,4-dimethyl-N-phenylquinazolin-7-amine
SMILESCc1nc(C)c2ccc(Nc3ccccc3)cc2n1
InChIInChI=1S/C16H15N3/c1-11-15-9-8-14(10-16(15)18-12(2)17-11)19-13-6-4-3-5-7-13/h3-10,19H,1-2H3
InChIKeyUSEMGADQDWPKDO-UHFFFAOYSA-N
MW249.32 g/mol
LogP3.99
Rot. Bonds2

About 2,4-dimethyl-N-phenylquinazolin-7-amine

2,4-dimethyl-N-phenylquinazolin-7-amine (PubChem CID 175557011) has the molecular formula C16H15N3 and a molecular weight of 249.32 g/mol. Its IUPAC name is 2,4-dimethyl-N-phenylquinazolin-7-amine.

Molecular Properties

Compound Name2,4-dimethyl-N-phenylquinazolin-7-amine
PubChem CID175557011
Molecular FormulaC16H15N3
Molecular Weight249.32 g/mol
Exact Mass249.13
IUPAC Name2,4-dimethyl-N-phenylquinazolin-7-amine
SMILESCc1nc(C)c2ccc(Nc3ccccc3)cc2n1
InChIInChI=1S/C16H15N3/c1-11-15-9-8-14(10-16(15)18-12(2)17-11)19-13-6-4-3-5-7-13/h3-10,19H,1-2H3
InChIKeyUSEMGADQDWPKDO-UHFFFAOYSA-N
XLogP3.99
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.32
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-N-phenylquinazolin-7-amine?
The IUPAC name of 2,4-dimethyl-N-phenylquinazolin-7-amine (CID 175557011) is 2,4-dimethyl-N-phenylquinazolin-7-amine.
What is the SMILES notation for 2,4-dimethyl-N-phenylquinazolin-7-amine?
The canonical SMILES for 2,4-dimethyl-N-phenylquinazolin-7-amine is Cc1nc(C)c2ccc(Nc3ccccc3)cc2n1.
What is the InChIKey of 2,4-dimethyl-N-phenylquinazolin-7-amine?
The InChIKey is USEMGADQDWPKDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3/c1-11-15-9-8-14(10-16(15)18-12(2)17-11)19-13-6-4-3-5-7-13/h3-10,19H,1-2H3.
What are the key properties of 2,4-dimethyl-N-phenylquinazolin-7-amine?
2,4-dimethyl-N-phenylquinazolin-7-amine has a molecular weight of 249.32 g/mol, XLogP of 3.99, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-N-phenylquinazolin-7-amine is sourced from PubChem (CID 175557011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).