6-chloro-2-cyclopentyl-7-methoxy-N-methylquinolin-4-amine

C16H19ClN2O — CID 107623129

IUPAC6-chloro-2-cyclopentyl-7-methoxy-N-methylquinolin-4-amine
SMILESCNc1cc(C2CCCC2)nc2cc(OC)c(Cl)cc12
InChIInChI=1S/C16H19ClN2O/c1-18-14-8-13(10-5-3-4-6-10)19-15-9-16(20-2)12(17)7-11(14)15/h7-10H,3-6H2,1-2H3,(H,18,19)
InChIKeyACSNJNDBWYYFTL-UHFFFAOYSA-N
MW290.79 g/mol
LogP4.60
Rot. Bonds3

About 6-chloro-2-cyclopentyl-7-methoxy-N-methylquinolin-4-amine

6-chloro-2-cyclopentyl-7-methoxy-N-methylquinolin-4-amine (PubChem CID 107623129) has the molecular formula C16H19ClN2O and a molecular weight of 290.79 g/mol. Its IUPAC name is 6-chloro-2-cyclopentyl-7-methoxy-N-methylquinolin-4-amine.

Molecular Properties

Compound Name6-chloro-2-cyclopentyl-7-methoxy-N-methylquinolin-4-amine
PubChem CID107623129
Molecular FormulaC16H19ClN2O
Molecular Weight290.79 g/mol
Exact Mass290.12
IUPAC Name6-chloro-2-cyclopentyl-7-methoxy-N-methylquinolin-4-amine
SMILESCNc1cc(C2CCCC2)nc2cc(OC)c(Cl)cc12
InChIInChI=1S/C16H19ClN2O/c1-18-14-8-13(10-5-3-4-6-10)19-15-9-16(20-2)12(17)7-11(14)15/h7-10H,3-6H2,1-2H3,(H,18,19)
InChIKeyACSNJNDBWYYFTL-UHFFFAOYSA-N
XLogP4.60
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.79
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-bromo-2-cyclopentyl-N-methylquinolin-4-amine
CID 113390564
2-cyclopropyl-8-methoxy-N-methylquinolin-4-amine
CID 63357697
2-cyclopropyl-N,6-dimethylquinolin-4-amine
CID 63358146
5-chloro-2,4-dimethoxy-N-methylaniline
CID 28576065
2,5-dichloro-4-methoxy-N-methylaniline
CID 82283226
8-chloro-2-cyclopropyl-N-methylquinolin-4-amine
CID 63358201
6-chloro-7-methoxy-2-methyl-N-propylquinolin-4-amine
CID 107623108
(2-cyclopentyl-7-fluoro-6-methylquinolin-4-yl)hydrazine
CID 113390617
6,7-dimethoxy-N-methyl-2-propan-2-ylquinolin-4-amine
CID 62203943
2-cyclobutyl-6,7-dimethoxy-4-methylquinazoline
CID 163275248
6-chloro-2-cyclopropyl-8-fluoro-N-methylquinolin-4-amine
CID 63357835
8,10-dichloro-7-methoxy-3,4-dihydro-1H-pyrano[4,3-b]quinoline
CID 107622850

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-cyclopentyl-7-methoxy-N-methylquinolin-4-amine?
The IUPAC name of 6-chloro-2-cyclopentyl-7-methoxy-N-methylquinolin-4-amine (CID 107623129) is 6-chloro-2-cyclopentyl-7-methoxy-N-methylquinolin-4-amine.
What is the SMILES notation for 6-chloro-2-cyclopentyl-7-methoxy-N-methylquinolin-4-amine?
The canonical SMILES for 6-chloro-2-cyclopentyl-7-methoxy-N-methylquinolin-4-amine is CNc1cc(C2CCCC2)nc2cc(OC)c(Cl)cc12.
What is the InChIKey of 6-chloro-2-cyclopentyl-7-methoxy-N-methylquinolin-4-amine?
The InChIKey is ACSNJNDBWYYFTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19ClN2O/c1-18-14-8-13(10-5-3-4-6-10)19-15-9-16(20-2)12(17)7-11(14)15/h7-10H,3-6H2,1-2H3,(H,18,19).
What are the key properties of 6-chloro-2-cyclopentyl-7-methoxy-N-methylquinolin-4-amine?
6-chloro-2-cyclopentyl-7-methoxy-N-methylquinolin-4-amine has a molecular weight of 290.79 g/mol, XLogP of 4.60, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-cyclopentyl-7-methoxy-N-methylquinolin-4-amine is sourced from PubChem (CID 107623129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).