N-[(Z)-1-phenylethylideneamino]quinazolin-4-amine

C16H14N4 — CID 7272632

IUPACN-[(Z)-1-phenylethylideneamino]quinazolin-4-amine
SMILESC/C(=N/Nc1ncnc2ccccc12)c1ccccc1
InChIInChI=1S/C16H14N4/c1-12(13-7-3-2-4-8-13)19-20-16-14-9-5-6-10-15(14)17-11-18-16/h2-11H,1H3,(H,17,18,20)/b19-12-
InChIKeyCVXAOQDXERVIGX-UNOMPAQXSA-N
MW262.32 g/mol
LogP3.47
Rot. Bonds3

About N-[(Z)-1-phenylethylideneamino]quinazolin-4-amine

N-[(Z)-1-phenylethylideneamino]quinazolin-4-amine (PubChem CID 7272632) has the molecular formula C16H14N4 and a molecular weight of 262.32 g/mol. Its IUPAC name is N-[(Z)-1-phenylethylideneamino]quinazolin-4-amine.

Molecular Properties

Compound NameN-[(Z)-1-phenylethylideneamino]quinazolin-4-amine
PubChem CID7272632
Molecular FormulaC16H14N4
Molecular Weight262.32 g/mol
Exact Mass262.12
IUPAC NameN-[(Z)-1-phenylethylideneamino]quinazolin-4-amine
SMILESC/C(=N/Nc1ncnc2ccccc12)c1ccccc1
InChIInChI=1S/C16H14N4/c1-12(13-7-3-2-4-8-13)19-20-16-14-9-5-6-10-15(14)17-11-18-16/h2-11H,1H3,(H,17,18,20)/b19-12-
InChIKeyCVXAOQDXERVIGX-UNOMPAQXSA-N
XLogP3.47
TPSA50.17 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.32
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-[(Z)-1-phenylethylideneamino]quinazolin-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

4-[(Z)-C-methyl-N-(quinazolin-4-ylamino)carbonimidoyl]phenol
CID 135877631
2-methyl-N-[(Z)-1-(4-methylphenyl)ethylideneamino]quinazolin-4-amine
CID 16747364
2-(4-methylphenyl)-N-[1-(4-methylphenyl)ethylideneamino]quinazolin-4-amine
CID 2848406
N-[(E)-1-(4-methoxyphenyl)ethylideneamino]-2-methylquinazolin-4-amine
CID 59846655
4-methyl-N-[(E)-1-phenylethylideneamino]quinolin-2-amine
CID 15352710
2-[(E)-(quinazolin-4-ylhydrazinylidene)methyl]phenol
CID 135713775
4-[(E)-C-methyl-N-(quinolin-4-ylamino)carbonimidoyl]benzoic acid
CID 167909211
3-hydroxy-2-[2-(1-phenylethylidene)hydrazinyl]quinazolin-4-one
CID 4888440
quinazolin-4-ylthiourea
CID 22649288
N-[(Z)-1-(3-aminophenyl)ethylideneamino]-6-phenylthieno[2,3-d]pyrimidin-4-amine
CID 9257586
N-(1-phenylethylideneamino)quinolin-2-amine
CID 618819
ethane;N-[(Z)-1-phenylethylideneamino]aniline
CID 91599108

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-1-phenylethylideneamino]quinazolin-4-amine?
The IUPAC name of N-[(Z)-1-phenylethylideneamino]quinazolin-4-amine (CID 7272632) is N-[(Z)-1-phenylethylideneamino]quinazolin-4-amine.
What is the SMILES notation for N-[(Z)-1-phenylethylideneamino]quinazolin-4-amine?
The canonical SMILES for N-[(Z)-1-phenylethylideneamino]quinazolin-4-amine is C/C(=N/Nc1ncnc2ccccc12)c1ccccc1.
What is the InChIKey of N-[(Z)-1-phenylethylideneamino]quinazolin-4-amine?
The InChIKey is CVXAOQDXERVIGX-UNOMPAQXSA-N. The full InChI is InChI=1S/C16H14N4/c1-12(13-7-3-2-4-8-13)19-20-16-14-9-5-6-10-15(14)17-11-18-16/h2-11H,1H3,(H,17,18,20)/b19-12-.
What are the key properties of N-[(Z)-1-phenylethylideneamino]quinazolin-4-amine?
N-[(Z)-1-phenylethylideneamino]quinazolin-4-amine has a molecular weight of 262.32 g/mol, XLogP of 3.47, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-1-phenylethylideneamino]quinazolin-4-amine is sourced from PubChem (CID 7272632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).