2-chlorobenzo[g]quinazolin-4-amine

C12H8ClN3 — CID 134830361

IUPAC2-chlorobenzo[g]quinazolin-4-amine
SMILESNc1nc(Cl)nc2cc3ccccc3cc12
InChIInChI=1S/C12H8ClN3/c13-12-15-10-6-8-4-2-1-3-7(8)5-9(10)11(14)16-12/h1-6H,(H2,14,15,16)
InChIKeyGIRCBDASUZPYDL-UHFFFAOYSA-N
MW229.67 g/mol
LogP3.02
Rot. Bonds

About 2-chlorobenzo[g]quinazolin-4-amine

2-chlorobenzo[g]quinazolin-4-amine (PubChem CID 134830361) has the molecular formula C12H8ClN3 and a molecular weight of 229.67 g/mol. Its IUPAC name is 2-chlorobenzo[g]quinazolin-4-amine.

Molecular Properties

Compound Name2-chlorobenzo[g]quinazolin-4-amine
PubChem CID134830361
Molecular FormulaC12H8ClN3
Molecular Weight229.67 g/mol
Exact Mass229.04
IUPAC Name2-chlorobenzo[g]quinazolin-4-amine
SMILESNc1nc(Cl)nc2cc3ccccc3cc12
InChIInChI=1S/C12H8ClN3/c13-12-15-10-6-8-4-2-1-3-7(8)5-9(10)11(14)16-12/h1-6H,(H2,14,15,16)
InChIKeyGIRCBDASUZPYDL-UHFFFAOYSA-N
XLogP3.02
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.67
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-propan-2-ylbenzo[g]quinazolin-4-amine
CID 106583882
4-amino-2-chloroquinazolin-7-ol
CID 136693537
2,5-dichloroquinazolin-4-amine
CID 34181658
1,4-dichloroanthracene
CID 3497125
2-chloro-5-fluoroquinazolin-4-amine
CID 34181642
2-chloro-5-phenylquinazolin-4-amine
CID 141301329
2-chloro-6-methyl-5-naphthalen-1-yloxypyrimidin-4-amine
CID 87714361
5,12-dichlorotetracene
CID 87498157
isoquinoline-1,3-diamine
CID 13032237
2-(2-chloroquinazolin-4-yl)sulfanylpyrimidine-4,6-diamine
CID 62477361
6,7-dichloro-2-methylquinazolin-4-amine
CID 122198309
2-chlorotetracen-1-amine
CID 175491990

Frequently Asked Questions

What is the IUPAC name of 2-chlorobenzo[g]quinazolin-4-amine?
The IUPAC name of 2-chlorobenzo[g]quinazolin-4-amine (CID 134830361) is 2-chlorobenzo[g]quinazolin-4-amine.
What is the SMILES notation for 2-chlorobenzo[g]quinazolin-4-amine?
The canonical SMILES for 2-chlorobenzo[g]quinazolin-4-amine is Nc1nc(Cl)nc2cc3ccccc3cc12.
What is the InChIKey of 2-chlorobenzo[g]quinazolin-4-amine?
The InChIKey is GIRCBDASUZPYDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8ClN3/c13-12-15-10-6-8-4-2-1-3-7(8)5-9(10)11(14)16-12/h1-6H,(H2,14,15,16).
What are the key properties of 2-chlorobenzo[g]quinazolin-4-amine?
2-chlorobenzo[g]quinazolin-4-amine has a molecular weight of 229.67 g/mol, XLogP of 3.02, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chlorobenzo[g]quinazolin-4-amine is sourced from PubChem (CID 134830361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).