(6S)-6-phenyl-5,6-dihydrobenzo[h]quinazolin-2-amine

C18H15N3 — CID 51346202

IUPAC(6S)-6-phenyl-5,6-dihydrobenzo[h]quinazolin-2-amine
SMILESNc1ncc2c(n1)-c1ccccc1[C@H](c1ccccc1)C2
InChIInChI=1S/C18H15N3/c19-18-20-11-13-10-16(12-6-2-1-3-7-12)14-8-4-5-9-15(14)17(13)21-18/h1-9,11,16H,10H2,(H2,19,20,21)/t16-/m0/s1
InChIKeyBMOQBIIJPJVMDI-INIZCTEOSA-N
MW273.34 g/mol
LogP3.41
Rot. Bonds1

About (6S)-6-phenyl-5,6-dihydrobenzo[h]quinazolin-2-amine

(6S)-6-phenyl-5,6-dihydrobenzo[h]quinazolin-2-amine (PubChem CID 51346202) has the molecular formula C18H15N3 and a molecular weight of 273.34 g/mol. Its IUPAC name is (6S)-6-phenyl-5,6-dihydrobenzo[h]quinazolin-2-amine.

Molecular Properties

Compound Name(6S)-6-phenyl-5,6-dihydrobenzo[h]quinazolin-2-amine
PubChem CID51346202
Molecular FormulaC18H15N3
Molecular Weight273.34 g/mol
Exact Mass273.13
IUPAC Name(6S)-6-phenyl-5,6-dihydrobenzo[h]quinazolin-2-amine
SMILESNc1ncc2c(n1)-c1ccccc1[C@H](c1ccccc1)C2
InChIInChI=1S/C18H15N3/c19-18-20-11-13-10-16(12-6-2-1-3-7-12)14-8-4-5-9-15(14)17(13)21-18/h1-9,11,16H,10H2,(H2,19,20,21)/t16-/m0/s1
InChIKeyBMOQBIIJPJVMDI-INIZCTEOSA-N
XLogP3.41
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (6S)-6-phenyl-5,6-dihydrobenzo[h]quinazolin-2-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

8-(Pyrimidin-2-Ylamino)Naphthalene-2-Carboximidamide
CID 448610
(NE)-N-[(7S)-2-amino-7-(4-fluoro-2-pyridin-3-ylphenyl)-4-methyl-7,8-dihydro-6H-quinazolin-5-ylidene]hydroxylamine
CID 46937132
5-Methyl-4-phenylpyrimidin-2-amine
CID 317238
4-(4-Phenylphenyl)pyrimidine
CID 817541
6-o-Tolylquinazolin-2-amine
CID 16086113
6-(Piperazin-1-yl)-3,5-diazatricyclo[8.4.0.0^{2,7}]tetradeca-1(14),2,4,6,10,12-hexaen-4-amine
CID 25071940
6-(4-Methylpiperazin-1-yl)-3,5-diazatricyclo[8.4.0.0^{2,7}]tetradeca-1(14),2,4,6,10,12-hexaen-4-amine
CID 25128822
(1-(4-(Naphthalen-2-yl)pyrimidin-2-yl)piperidin-4-yl)methanamine
CID 25199517
5,6-Dihydrobenzo[h]quinazolin-2-amine
CID 2763483
N-phenyl-5,6,7,8-tetrahydroquinazolin-2-amine
CID 51371056
5,5-Dimethyl-8-[1-(piperidin-4-yl)ethenyl]-5,6-dihydrobenzo[h]quinazolin-4-amine
CID 134817499
5-(Naphthalen-2-ylmethyl)pyrimidine-2,4-diamine
CID 516669

Frequently Asked Questions

What is the IUPAC name of (6S)-6-phenyl-5,6-dihydrobenzo[h]quinazolin-2-amine?
The IUPAC name of (6S)-6-phenyl-5,6-dihydrobenzo[h]quinazolin-2-amine (CID 51346202) is (6S)-6-phenyl-5,6-dihydrobenzo[h]quinazolin-2-amine.
What is the SMILES notation for (6S)-6-phenyl-5,6-dihydrobenzo[h]quinazolin-2-amine?
The canonical SMILES for (6S)-6-phenyl-5,6-dihydrobenzo[h]quinazolin-2-amine is Nc1ncc2c(n1)-c1ccccc1[C@H](c1ccccc1)C2.
What is the InChIKey of (6S)-6-phenyl-5,6-dihydrobenzo[h]quinazolin-2-amine?
The InChIKey is BMOQBIIJPJVMDI-INIZCTEOSA-N. The full InChI is InChI=1S/C18H15N3/c19-18-20-11-13-10-16(12-6-2-1-3-7-12)14-8-4-5-9-15(14)17(13)21-18/h1-9,11,16H,10H2,(H2,19,20,21)/t16-/m0/s1.
What are the key properties of (6S)-6-phenyl-5,6-dihydrobenzo[h]quinazolin-2-amine?
(6S)-6-phenyl-5,6-dihydrobenzo[h]quinazolin-2-amine has a molecular weight of 273.34 g/mol, XLogP of 3.41, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6S)-6-phenyl-5,6-dihydrobenzo[h]quinazolin-2-amine is sourced from PubChem (CID 51346202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).