2-chloro-N-cyclohexyl-7-methylquinazolin-4-amine

C15H18ClN3 — CID 134109451

IUPAC2-chloro-N-cyclohexyl-7-methylquinazolin-4-amine
SMILESCc1ccc2c(NC3CCCCC3)nc(Cl)nc2c1
InChIInChI=1S/C15H18ClN3/c1-10-7-8-12-13(9-10)18-15(16)19-14(12)17-11-5-3-2-4-6-11/h7-9,11H,2-6H2,1H3,(H,17,18,19)
InChIKeyNKZSRVGCDMIVAA-UHFFFAOYSA-N
MW275.78 g/mol
LogP4.34
Rot. Bonds2

About 2-chloro-N-cyclohexyl-7-methylquinazolin-4-amine

2-chloro-N-cyclohexyl-7-methylquinazolin-4-amine (PubChem CID 134109451) has the molecular formula C15H18ClN3 and a molecular weight of 275.78 g/mol. Its IUPAC name is 2-chloro-N-cyclohexyl-7-methylquinazolin-4-amine.

Molecular Properties

Compound Name2-chloro-N-cyclohexyl-7-methylquinazolin-4-amine
PubChem CID134109451
Molecular FormulaC15H18ClN3
Molecular Weight275.78 g/mol
Exact Mass275.12
IUPAC Name2-chloro-N-cyclohexyl-7-methylquinazolin-4-amine
SMILESCc1ccc2c(NC3CCCCC3)nc(Cl)nc2c1
InChIInChI=1S/C15H18ClN3/c1-10-7-8-12-13(9-10)18-15(16)19-14(12)17-11-5-3-2-4-6-11/h7-9,11H,2-6H2,1H3,(H,17,18,19)
InChIKeyNKZSRVGCDMIVAA-UHFFFAOYSA-N
XLogP4.34
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.78
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-chloro-N-cyclohexyl-7-methylquinazolin-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

2-chloro-N-cycloheptylquinazolin-4-amine
CID 22692826
2-chloro-N-cyclododecylquinazolin-4-amine
CID 22692916
2,7-dichloro-N-cyclopropylquinazolin-4-amine
CID 114693120
2-chloro-N-cyclopentyl-6,7-dimethoxyquinazolin-4-amine
CID 22692592
2-chloro-N-cyclohexyl-5,6-dimethylpyrimidin-4-amine
CID 82460626
2-chloro-N-cyclooctyl-6-methylpyrimidin-4-amine
CID 62477966
2,5-dichloro-N-cyclopentylpyrimidin-4-amine
CID 79633393
2-chloro-N-cyclohexyl-5-fluoropyrimidin-4-amine
CID 3573094
2-chloro-6,7-dimethoxy-N-(oxan-4-yl)quinazolin-4-amine
CID 46901939
2-chloro-N-cyclopropyl-6-pyrrolidin-1-ylquinazolin-4-amine
CID 114693340
7-methyl-N-(3-methylcyclohexyl)-2,3-dihydro-1H-cyclopenta[c]quinolin-4-amine
CID 135170169
4,7-dichloro-N-cyclohexylquinolin-2-amine
CID 162413926

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-cyclohexyl-7-methylquinazolin-4-amine?
The IUPAC name of 2-chloro-N-cyclohexyl-7-methylquinazolin-4-amine (CID 134109451) is 2-chloro-N-cyclohexyl-7-methylquinazolin-4-amine.
What is the SMILES notation for 2-chloro-N-cyclohexyl-7-methylquinazolin-4-amine?
The canonical SMILES for 2-chloro-N-cyclohexyl-7-methylquinazolin-4-amine is Cc1ccc2c(NC3CCCCC3)nc(Cl)nc2c1.
What is the InChIKey of 2-chloro-N-cyclohexyl-7-methylquinazolin-4-amine?
The InChIKey is NKZSRVGCDMIVAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18ClN3/c1-10-7-8-12-13(9-10)18-15(16)19-14(12)17-11-5-3-2-4-6-11/h7-9,11H,2-6H2,1H3,(H,17,18,19).
What are the key properties of 2-chloro-N-cyclohexyl-7-methylquinazolin-4-amine?
2-chloro-N-cyclohexyl-7-methylquinazolin-4-amine has a molecular weight of 275.78 g/mol, XLogP of 4.34, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-cyclohexyl-7-methylquinazolin-4-amine is sourced from PubChem (CID 134109451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).