N-(3-chlorophenyl)-2-phenylquinazolin-4-amine

C20H14ClN3 — CID 2789499

IUPACN-(3-chlorophenyl)-2-phenylquinazolin-4-amine
SMILESClc1cccc(Nc2nc(-c3ccccc3)nc3ccccc23)c1
InChIInChI=1S/C20H14ClN3/c21-15-9-6-10-16(13-15)22-20-17-11-4-5-12-18(17)23-19(24-20)14-7-2-1-3-8-14/h1-13H,(H,22,23,24)
InChIKeyFYOVPXMSRXGEEZ-UHFFFAOYSA-N
MW331.81 g/mol
LogP5.69
Rot. Bonds3

About N-(3-chlorophenyl)-2-phenylquinazolin-4-amine

N-(3-chlorophenyl)-2-phenylquinazolin-4-amine (PubChem CID 2789499) has the molecular formula C20H14ClN3 and a molecular weight of 331.81 g/mol. Its IUPAC name is N-(3-chlorophenyl)-2-phenylquinazolin-4-amine.

Molecular Properties

Compound NameN-(3-chlorophenyl)-2-phenylquinazolin-4-amine
PubChem CID2789499
Molecular FormulaC20H14ClN3
Molecular Weight331.81 g/mol
Exact Mass331.09
IUPAC NameN-(3-chlorophenyl)-2-phenylquinazolin-4-amine
SMILESClc1cccc(Nc2nc(-c3ccccc3)nc3ccccc23)c1
InChIInChI=1S/C20H14ClN3/c21-15-9-6-10-16(13-15)22-20-17-11-4-5-12-18(17)23-19(24-20)14-7-2-1-3-8-14/h1-13H,(H,22,23,24)
InChIKeyFYOVPXMSRXGEEZ-UHFFFAOYSA-N
XLogP5.69
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500331.81
LogP ≤ 55.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(3-chlorophenyl)-2-phenylquinazolin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N2,N4-Dibenzylquinazoline-2,4-diamine
CID 676352
2,4-Diaminoquinazoline
CID 65087
N-Benzyl-2-phenyl-4-quinazolinamine
CID 780643
4-(3-Chloroanilino)quinazoline
CID 128872
4-Anilinoquinazoline
CID 324081
N-(3-methylphenyl)quinazolin-4-amine
CID 659954
2,4-Quinazolinediamine, 5-chloro-
CID 205130
6-Chloro-4-phenyl-2-(piperazin-1-yl)quinazoline
CID 658787
4-Chloro-2,6-diphenylpyrimidine
CID 582041
N~2~-(3-chloro-4-methylphenyl)-2,4-quinazolinediamine hydrochloride
CID 2972826
N-(2-phenylethyl)quinazolin-4-amine
CID 198909
N,2-diphenylquinazolin-4-amine
CID 698960

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-2-phenylquinazolin-4-amine?
The IUPAC name of N-(3-chlorophenyl)-2-phenylquinazolin-4-amine (CID 2789499) is N-(3-chlorophenyl)-2-phenylquinazolin-4-amine.
What is the SMILES notation for N-(3-chlorophenyl)-2-phenylquinazolin-4-amine?
The canonical SMILES for N-(3-chlorophenyl)-2-phenylquinazolin-4-amine is Clc1cccc(Nc2nc(-c3ccccc3)nc3ccccc23)c1.
What is the InChIKey of N-(3-chlorophenyl)-2-phenylquinazolin-4-amine?
The InChIKey is FYOVPXMSRXGEEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14ClN3/c21-15-9-6-10-16(13-15)22-20-17-11-4-5-12-18(17)23-19(24-20)14-7-2-1-3-8-14/h1-13H,(H,22,23,24).
What are the key properties of N-(3-chlorophenyl)-2-phenylquinazolin-4-amine?
N-(3-chlorophenyl)-2-phenylquinazolin-4-amine has a molecular weight of 331.81 g/mol, XLogP of 5.69, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-2-phenylquinazolin-4-amine is sourced from PubChem (CID 2789499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).