4,7-dichloro-N-cyclohexylquinolin-2-amine

C15H16Cl2N2 — CID 162413926

IUPAC4,7-dichloro-N-cyclohexylquinolin-2-amine
SMILESClc1ccc2c(Cl)cc(NC3CCCCC3)nc2c1
InChIInChI=1S/C15H16Cl2N2/c16-10-6-7-12-13(17)9-15(19-14(12)8-10)18-11-4-2-1-3-5-11/h6-9,11H,1-5H2,(H,18,19)
InChIKeyBSKUTXWYVLMEFU-UHFFFAOYSA-N
MW295.21 g/mol
LogP5.29
Rot. Bonds2

About 4,7-dichloro-N-cyclohexylquinolin-2-amine

4,7-dichloro-N-cyclohexylquinolin-2-amine (PubChem CID 162413926) has the molecular formula C15H16Cl2N2 and a molecular weight of 295.21 g/mol. Its IUPAC name is 4,7-dichloro-N-cyclohexylquinolin-2-amine.

Molecular Properties

Compound Name4,7-dichloro-N-cyclohexylquinolin-2-amine
PubChem CID162413926
Molecular FormulaC15H16Cl2N2
Molecular Weight295.21 g/mol
Exact Mass294.07
IUPAC Name4,7-dichloro-N-cyclohexylquinolin-2-amine
SMILESClc1ccc2c(Cl)cc(NC3CCCCC3)nc2c1
InChIInChI=1S/C15H16Cl2N2/c16-10-6-7-12-13(17)9-15(19-14(12)8-10)18-11-4-2-1-3-5-11/h6-9,11H,1-5H2,(H,18,19)
InChIKeyBSKUTXWYVLMEFU-UHFFFAOYSA-N
XLogP5.29
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500295.21
LogP ≤ 55.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[(7-chloro-4-methylquinolin-2-yl)amino]cyclohexan-1-ol
CID 31196506
7-chloro-N-cyclohexylisoquinolin-3-amine
CID 134986887
4-chloro-N-cyclohexylquinolin-2-amine;N,2,2-trimethylpropanamide
CID 144970640
2,7-dichloro-N-cyclopropylquinazolin-4-amine
CID 114693120
6-chloro-N-cyclohexylquinazolin-4-amine
CID 13231193
2-(cyclopentylamino)quinolin-5-ol
CID 137253118
6-N-(4-chloro-2-methylphenyl)-4-N-cyclohexyl-2-methylpyrimidine-4,6-diamine
CID 112869075
2-chloro-N-cyclooctyl-6-methylpyrimidin-4-amine
CID 62477966
7-chloro-4-(cyclohexylmethyl)quinoline
CID 122374976
6-(cyclohexylamino)-N-(2,5-dichlorophenyl)pyridine-3-carboxamide
CID 109152458
N-(azepan-4-yl)-7-chloroquinolin-4-amine
CID 107173682
2-chloro-N-cyclohexyl-7-methylquinazolin-4-amine
CID 134109451

Frequently Asked Questions

What is the IUPAC name of 4,7-dichloro-N-cyclohexylquinolin-2-amine?
The IUPAC name of 4,7-dichloro-N-cyclohexylquinolin-2-amine (CID 162413926) is 4,7-dichloro-N-cyclohexylquinolin-2-amine.
What is the SMILES notation for 4,7-dichloro-N-cyclohexylquinolin-2-amine?
The canonical SMILES for 4,7-dichloro-N-cyclohexylquinolin-2-amine is Clc1ccc2c(Cl)cc(NC3CCCCC3)nc2c1.
What is the InChIKey of 4,7-dichloro-N-cyclohexylquinolin-2-amine?
The InChIKey is BSKUTXWYVLMEFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16Cl2N2/c16-10-6-7-12-13(17)9-15(19-14(12)8-10)18-11-4-2-1-3-5-11/h6-9,11H,1-5H2,(H,18,19).
What are the key properties of 4,7-dichloro-N-cyclohexylquinolin-2-amine?
4,7-dichloro-N-cyclohexylquinolin-2-amine has a molecular weight of 295.21 g/mol, XLogP of 5.29, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,7-dichloro-N-cyclohexylquinolin-2-amine is sourced from PubChem (CID 162413926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).