2-phenylpyrido[3,4-g]quinazolin-10-amine

C17H12N4 — CID 162650720

IUPAC2-phenylpyrido[3,4-g]quinazolin-10-amine
SMILESNc1c2ccncc2cc2cnc(-c3ccccc3)nc12
InChIInChI=1S/C17H12N4/c18-15-14-6-7-19-9-12(14)8-13-10-20-17(21-16(13)15)11-4-2-1-3-5-11/h1-10H,18H2
InChIKeyUJKOKFUHOFKRNN-UHFFFAOYSA-N
MW272.31 g/mol
LogP3.43
Rot. Bonds1

About 2-phenylpyrido[3,4-g]quinazolin-10-amine

2-phenylpyrido[3,4-g]quinazolin-10-amine (PubChem CID 162650720) has the molecular formula C17H12N4 and a molecular weight of 272.31 g/mol. Its IUPAC name is 2-phenylpyrido[3,4-g]quinazolin-10-amine.

Molecular Properties

Compound Name2-phenylpyrido[3,4-g]quinazolin-10-amine
PubChem CID162650720
Molecular FormulaC17H12N4
Molecular Weight272.31 g/mol
Exact Mass272.11
IUPAC Name2-phenylpyrido[3,4-g]quinazolin-10-amine
SMILESNc1c2ccncc2cc2cnc(-c3ccccc3)nc12
InChIInChI=1S/C17H12N4/c18-15-14-6-7-19-9-12(14)8-13-10-20-17(21-16(13)15)11-4-2-1-3-5-11/h1-10H,18H2
InChIKeyUJKOKFUHOFKRNN-UHFFFAOYSA-N
XLogP3.43
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-phenylpyrido[3,4-g]quinazolin-10-amine?
The IUPAC name of 2-phenylpyrido[3,4-g]quinazolin-10-amine (CID 162650720) is 2-phenylpyrido[3,4-g]quinazolin-10-amine.
What is the SMILES notation for 2-phenylpyrido[3,4-g]quinazolin-10-amine?
The canonical SMILES for 2-phenylpyrido[3,4-g]quinazolin-10-amine is Nc1c2ccncc2cc2cnc(-c3ccccc3)nc12.
What is the InChIKey of 2-phenylpyrido[3,4-g]quinazolin-10-amine?
The InChIKey is UJKOKFUHOFKRNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N4/c18-15-14-6-7-19-9-12(14)8-13-10-20-17(21-16(13)15)11-4-2-1-3-5-11/h1-10H,18H2.
What are the key properties of 2-phenylpyrido[3,4-g]quinazolin-10-amine?
2-phenylpyrido[3,4-g]quinazolin-10-amine has a molecular weight of 272.31 g/mol, XLogP of 3.43, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenylpyrido[3,4-g]quinazolin-10-amine is sourced from PubChem (CID 162650720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).