2-(3-chlorophenyl)-N-methyl-1-quinolin-8-ylethanamine

C18H17ClN2 — CID 81210656

IUPAC2-(3-chlorophenyl)-N-methyl-1-quinolin-8-ylethanamine
SMILESCNC(Cc1cccc(Cl)c1)c1cccc2cccnc12
InChIInChI=1S/C18H17ClN2/c1-20-17(12-13-5-2-8-15(19)11-13)16-9-3-6-14-7-4-10-21-18(14)16/h2-11,17,20H,12H2,1H3
InChIKeyGMDCLHICFMYCAB-UHFFFAOYSA-N
MW296.80 g/mol
LogP4.39
Rot. Bonds4

About 2-(3-chlorophenyl)-N-methyl-1-quinolin-8-ylethanamine

2-(3-chlorophenyl)-N-methyl-1-quinolin-8-ylethanamine (PubChem CID 81210656) has the molecular formula C18H17ClN2 and a molecular weight of 296.80 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-N-methyl-1-quinolin-8-ylethanamine.

Molecular Properties

Compound Name2-(3-chlorophenyl)-N-methyl-1-quinolin-8-ylethanamine
PubChem CID81210656
Molecular FormulaC18H17ClN2
Molecular Weight296.80 g/mol
Exact Mass296.11
IUPAC Name2-(3-chlorophenyl)-N-methyl-1-quinolin-8-ylethanamine
SMILESCNC(Cc1cccc(Cl)c1)c1cccc2cccnc12
InChIInChI=1S/C18H17ClN2/c1-20-17(12-13-5-2-8-15(19)11-13)16-9-3-6-14-7-4-10-21-18(14)16/h2-11,17,20H,12H2,1H3
InChIKeyGMDCLHICFMYCAB-UHFFFAOYSA-N
XLogP4.39
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.80
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(3-chlorophenyl)-N-methyl-1-quinolin-8-ylethanamine 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-(3-chlorophenyl)-N-methyl-1-(2-methyl-3-pyridinyl)ethanamine
CID 105085790
2-(furan-3-yl)-N-methyl-1-quinolin-8-ylethanamine
CID 105177547
N-methyl-2-(1-methylpyrazol-4-yl)-1-quinolin-8-ylethanamine
CID 105113637
2-(3-chlorophenyl)-1-(2,5-dichlorophenyl)-N-methylethanamine
CID 63412206
2-(3-chlorophenyl)-1-isoquinolin-4-yl-N-methylethanamine
CID 63940548
N-methyl-1-quinolin-8-ylbut-3-yn-1-amine
CID 105077186
3,3,3-trifluoro-N-methyl-1-quinolin-8-ylpropan-1-amine
CID 81231735
N-methyl-1-quinolin-8-ylpent-4-yn-1-amine
CID 105148985
2-(3-chlorophenyl)-1-(2-methyl-3-pyridinyl)ethanol
CID 105076776
3-[2-(3-chlorophenyl)-1-hydrazinylethyl]pyridin-2-amine
CID 105194946
2-(3-chlorophenyl)-1-(2,3-dihydro-1,4-benzodioxin-5-yl)-N-methylethanamine
CID 62503751
2-(3-chlorophenyl)-N-methyl-1-naphthalen-2-ylethanamine
CID 63412161

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-N-methyl-1-quinolin-8-ylethanamine?
The IUPAC name of 2-(3-chlorophenyl)-N-methyl-1-quinolin-8-ylethanamine (CID 81210656) is 2-(3-chlorophenyl)-N-methyl-1-quinolin-8-ylethanamine.
What is the SMILES notation for 2-(3-chlorophenyl)-N-methyl-1-quinolin-8-ylethanamine?
The canonical SMILES for 2-(3-chlorophenyl)-N-methyl-1-quinolin-8-ylethanamine is CNC(Cc1cccc(Cl)c1)c1cccc2cccnc12.
What is the InChIKey of 2-(3-chlorophenyl)-N-methyl-1-quinolin-8-ylethanamine?
The InChIKey is GMDCLHICFMYCAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17ClN2/c1-20-17(12-13-5-2-8-15(19)11-13)16-9-3-6-14-7-4-10-21-18(14)16/h2-11,17,20H,12H2,1H3.
What are the key properties of 2-(3-chlorophenyl)-N-methyl-1-quinolin-8-ylethanamine?
2-(3-chlorophenyl)-N-methyl-1-quinolin-8-ylethanamine has a molecular weight of 296.80 g/mol, XLogP of 4.39, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-N-methyl-1-quinolin-8-ylethanamine is sourced from PubChem (CID 81210656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).