N-(3-chloro-4-methoxyphenyl)-6-methoxy-2-methylquinolin-4-amine

C18H17ClN2O2 — CID 798244

IUPACN-(3-chloro-4-methoxyphenyl)-6-methoxy-2-methylquinolin-4-amine
SMILESCOc1ccc2nc(C)cc(Nc3ccc(OC)c(Cl)c3)c2c1
InChIInChI=1S/C18H17ClN2O2/c1-11-8-17(14-10-13(22-2)5-6-16(14)20-11)21-12-4-7-18(23-3)15(19)9-12/h4-10H,1-3H3,(H,20,21)
InChIKeyLPJBDURFGOPNNW-UHFFFAOYSA-N
MW328.80 g/mol
LogP4.96
Rot. Bonds4

About N-(3-chloro-4-methoxyphenyl)-6-methoxy-2-methylquinolin-4-amine

N-(3-chloro-4-methoxyphenyl)-6-methoxy-2-methylquinolin-4-amine (PubChem CID 798244) has the molecular formula C18H17ClN2O2 and a molecular weight of 328.80 g/mol. Its IUPAC name is N-(3-chloro-4-methoxyphenyl)-6-methoxy-2-methylquinolin-4-amine.

Molecular Properties

Compound NameN-(3-chloro-4-methoxyphenyl)-6-methoxy-2-methylquinolin-4-amine
PubChem CID798244
Molecular FormulaC18H17ClN2O2
Molecular Weight328.80 g/mol
Exact Mass328.10
IUPAC NameN-(3-chloro-4-methoxyphenyl)-6-methoxy-2-methylquinolin-4-amine
SMILESCOc1ccc2nc(C)cc(Nc3ccc(OC)c(Cl)c3)c2c1
InChIInChI=1S/C18H17ClN2O2/c1-11-8-17(14-10-13(22-2)5-6-16(14)20-11)21-12-4-7-18(23-3)15(19)9-12/h4-10H,1-3H3,(H,20,21)
InChIKeyLPJBDURFGOPNNW-UHFFFAOYSA-N
XLogP4.96
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.80
LogP ≤ 54.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-chloro-4-fluorophenyl)-6-methoxy-2-methylquinolin-4-amine
CID 110435673
N-(3-chlorophenyl)-6-methoxy-2-methylquinolin-4-amine
CID 692374
N-(5-chloro-2-methoxyphenyl)-6-methoxy-2-methylquinolin-4-amine
CID 886675
6-chloro-N-(3,4-dimethoxyphenyl)-2-methylquinolin-4-amine
CID 23793112
N-(4-fluorophenyl)-6-methoxy-2-methylquinolin-4-amine
CID 798853
6-methoxy-2-methyl-N-(4-propan-2-yloxyphenyl)quinolin-4-amine
CID 110435675
N-(3,4-dimethoxyphenyl)-7-methoxy-2-methylquinolin-4-amine
CID 110435623
N-(3-chloro-4-methoxyphenyl)-8-methoxy-2-methylquinolin-4-amine
CID 798258
N-(3-chloro-4-methylphenyl)-6-ethoxy-2-methylquinolin-4-amine
CID 948543
6-ethoxy-N-(4-methoxyphenyl)-2-methylquinolin-4-amine
CID 696588
6-chloro-N-(3,4-dichlorophenyl)-2-methylquinolin-4-amine
CID 730833
4-[(6-methoxy-2-methylquinolin-4-yl)amino]benzoate
CID 3687425

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-methoxyphenyl)-6-methoxy-2-methylquinolin-4-amine?
The IUPAC name of N-(3-chloro-4-methoxyphenyl)-6-methoxy-2-methylquinolin-4-amine (CID 798244) is N-(3-chloro-4-methoxyphenyl)-6-methoxy-2-methylquinolin-4-amine.
What is the SMILES notation for N-(3-chloro-4-methoxyphenyl)-6-methoxy-2-methylquinolin-4-amine?
The canonical SMILES for N-(3-chloro-4-methoxyphenyl)-6-methoxy-2-methylquinolin-4-amine is COc1ccc2nc(C)cc(Nc3ccc(OC)c(Cl)c3)c2c1.
What is the InChIKey of N-(3-chloro-4-methoxyphenyl)-6-methoxy-2-methylquinolin-4-amine?
The InChIKey is LPJBDURFGOPNNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17ClN2O2/c1-11-8-17(14-10-13(22-2)5-6-16(14)20-11)21-12-4-7-18(23-3)15(19)9-12/h4-10H,1-3H3,(H,20,21).
What are the key properties of N-(3-chloro-4-methoxyphenyl)-6-methoxy-2-methylquinolin-4-amine?
N-(3-chloro-4-methoxyphenyl)-6-methoxy-2-methylquinolin-4-amine has a molecular weight of 328.80 g/mol, XLogP of 4.96, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-methoxyphenyl)-6-methoxy-2-methylquinolin-4-amine is sourced from PubChem (CID 798244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).