2-(6-chloro-5,8-dimethoxy-2-methylquinolin-3-yl)-N-methylethanamine

C15H19ClN2O2 — CID 82251405

IUPAC2-(6-chloro-5,8-dimethoxy-2-methylquinolin-3-yl)-N-methylethanamine
SMILESCNCCc1cc2c(OC)c(Cl)cc(OC)c2nc1C
InChIInChI=1S/C15H19ClN2O2/c1-9-10(5-6-17-2)7-11-14(18-9)13(19-3)8-12(16)15(11)20-4/h7-8,17H,5-6H2,1-4H3
InChIKeyFOVZNBABOMKHOC-UHFFFAOYSA-N
MW294.78 g/mol
LogP2.98
Rot. Bonds5

About 2-(6-chloro-5,8-dimethoxy-2-methylquinolin-3-yl)-N-methylethanamine

2-(6-chloro-5,8-dimethoxy-2-methylquinolin-3-yl)-N-methylethanamine (PubChem CID 82251405) has the molecular formula C15H19ClN2O2 and a molecular weight of 294.78 g/mol. Its IUPAC name is 2-(6-chloro-5,8-dimethoxy-2-methylquinolin-3-yl)-N-methylethanamine.

Molecular Properties

Compound Name2-(6-chloro-5,8-dimethoxy-2-methylquinolin-3-yl)-N-methylethanamine
PubChem CID82251405
Molecular FormulaC15H19ClN2O2
Molecular Weight294.78 g/mol
Exact Mass294.11
IUPAC Name2-(6-chloro-5,8-dimethoxy-2-methylquinolin-3-yl)-N-methylethanamine
SMILESCNCCc1cc2c(OC)c(Cl)cc(OC)c2nc1C
InChIInChI=1S/C15H19ClN2O2/c1-9-10(5-6-17-2)7-11-14(18-9)13(19-3)8-12(16)15(11)20-4/h7-8,17H,5-6H2,1-4H3
InChIKeyFOVZNBABOMKHOC-UHFFFAOYSA-N
XLogP2.98
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.78
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-Chloro-5,8-dimethoxy-3-phenylquinoline
CID 5329282
2-Chloro-5,8-dimethoxy-4-methylquinoline
CID 269158
N-benzyl-1-(2-chloro-5,8-dimethoxyquinolin-3-yl)methanimine oxide
CID 152150429
1,4-Pentanediamine, N(sup 1),N(sup 1)-diethyl-N(sup 4)-(5,8-dimethoxy-2,3-dimethyl-6-quinolinyl)-
CID 3041929
Quinoline, 2-chloro-5,8-dimethoxy-
CID 14935881
4-N-(5,8-dimethoxy-2,4-dimethylquinolin-6-yl)pentane-1,4-diamine;hydrate;hydrochloride
CID 90675304
4-chloro-N-[(E)-(2-chloro-8-methyl-3-quinolinyl)methylidene]-2,5-dimethoxyaniline
CID 1286571
1-{[2-(3-Chlorophenyl)-5,8-dimethoxy-3-quinolinyl]methyl}-4-piperidinol
CID 70734686
1-{[2-(3-Chlorophenyl)-5,8-dimethoxy-3-quinolinyl]methyl}-3-azetidinol
CID 70735199
2,4-Dichloro-5,8-dimethoxyquinoline
CID 12325617
2-Chloro-5,8-dimethoxy-3,4-dimethylquinoline
CID 322286
4-Chloro-5,8-dimethoxy-2-(trifluoromethyl)quinoline
CID 623987

Frequently Asked Questions

What is the IUPAC name of 2-(6-chloro-5,8-dimethoxy-2-methylquinolin-3-yl)-N-methylethanamine?
The IUPAC name of 2-(6-chloro-5,8-dimethoxy-2-methylquinolin-3-yl)-N-methylethanamine (CID 82251405) is 2-(6-chloro-5,8-dimethoxy-2-methylquinolin-3-yl)-N-methylethanamine.
What is the SMILES notation for 2-(6-chloro-5,8-dimethoxy-2-methylquinolin-3-yl)-N-methylethanamine?
The canonical SMILES for 2-(6-chloro-5,8-dimethoxy-2-methylquinolin-3-yl)-N-methylethanamine is CNCCc1cc2c(OC)c(Cl)cc(OC)c2nc1C.
What is the InChIKey of 2-(6-chloro-5,8-dimethoxy-2-methylquinolin-3-yl)-N-methylethanamine?
The InChIKey is FOVZNBABOMKHOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19ClN2O2/c1-9-10(5-6-17-2)7-11-14(18-9)13(19-3)8-12(16)15(11)20-4/h7-8,17H,5-6H2,1-4H3.
What are the key properties of 2-(6-chloro-5,8-dimethoxy-2-methylquinolin-3-yl)-N-methylethanamine?
2-(6-chloro-5,8-dimethoxy-2-methylquinolin-3-yl)-N-methylethanamine has a molecular weight of 294.78 g/mol, XLogP of 2.98, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-chloro-5,8-dimethoxy-2-methylquinolin-3-yl)-N-methylethanamine is sourced from PubChem (CID 82251405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).