N-methyl-1-(3-methylphenyl)-1-quinolin-5-ylmethanamine

C18H18N2 — CID 81220394

IUPACN-methyl-1-(3-methylphenyl)-1-quinolin-5-ylmethanamine
SMILESCNC(c1cccc(C)c1)c1cccc2ncccc12
InChIInChI=1S/C18H18N2/c1-13-6-3-7-14(12-13)18(19-2)16-8-4-10-17-15(16)9-5-11-20-17/h3-12,18-19H,1-2H3
InChIKeyWDOYAJJMMOXNBM-UHFFFAOYSA-N
MW262.36 g/mol
LogP3.85
Rot. Bonds3

About N-methyl-1-(3-methylphenyl)-1-quinolin-5-ylmethanamine

N-methyl-1-(3-methylphenyl)-1-quinolin-5-ylmethanamine (PubChem CID 81220394) has the molecular formula C18H18N2 and a molecular weight of 262.36 g/mol. Its IUPAC name is N-methyl-1-(3-methylphenyl)-1-quinolin-5-ylmethanamine.

Molecular Properties

Compound NameN-methyl-1-(3-methylphenyl)-1-quinolin-5-ylmethanamine
PubChem CID81220394
Molecular FormulaC18H18N2
Molecular Weight262.36 g/mol
Exact Mass262.15
IUPAC NameN-methyl-1-(3-methylphenyl)-1-quinolin-5-ylmethanamine
SMILESCNC(c1cccc(C)c1)c1cccc2ncccc12
InChIInChI=1S/C18H18N2/c1-13-6-3-7-14(12-13)18(19-2)16-8-4-10-17-15(16)9-5-11-20-17/h3-12,18-19H,1-2H3
InChIKeyWDOYAJJMMOXNBM-UHFFFAOYSA-N
XLogP3.85
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3,5-dimethylphenyl)-N-methyl-1-quinolin-5-ylmethanamine
CID 105020075
N-methyl-1-(5-methylthiophen-3-yl)-1-quinolin-5-ylmethanamine
CID 105155662
1-(4-fluorophenyl)-N-methyl-1-quinolin-5-ylmethanamine
CID 78917800
1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinolin-5-ylmethanamine
CID 105102666
1-(2,4-dichlorophenyl)-N-methyl-1-quinolin-5-ylmethanamine
CID 115604968
1-(4,5-dimethylthiophen-2-yl)-N-methyl-1-quinolin-5-ylmethanamine
CID 105020135
1-(2-iodophenyl)-N-methyl-1-quinolin-5-ylmethanamine
CID 105020092
1-(2,3-dimethoxyphenyl)-N-methyl-1-(3-methylphenyl)methanamine
CID 105090742
1-(4-bromo-2-chlorophenyl)-N-methyl-1-quinolin-5-ylmethanamine
CID 105020044
N-methyl-1-(3-methylthiophen-2-yl)-1-quinolin-5-ylmethanamine
CID 115604972
1-(2-bromo-4-chlorophenyl)-N-methyl-1-quinolin-5-ylmethanamine
CID 107994637
[phenyl(quinolin-5-yl)methyl]hydrazine
CID 105199350

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(3-methylphenyl)-1-quinolin-5-ylmethanamine?
The IUPAC name of N-methyl-1-(3-methylphenyl)-1-quinolin-5-ylmethanamine (CID 81220394) is N-methyl-1-(3-methylphenyl)-1-quinolin-5-ylmethanamine.
What is the SMILES notation for N-methyl-1-(3-methylphenyl)-1-quinolin-5-ylmethanamine?
The canonical SMILES for N-methyl-1-(3-methylphenyl)-1-quinolin-5-ylmethanamine is CNC(c1cccc(C)c1)c1cccc2ncccc12.
What is the InChIKey of N-methyl-1-(3-methylphenyl)-1-quinolin-5-ylmethanamine?
The InChIKey is WDOYAJJMMOXNBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2/c1-13-6-3-7-14(12-13)18(19-2)16-8-4-10-17-15(16)9-5-11-20-17/h3-12,18-19H,1-2H3.
What are the key properties of N-methyl-1-(3-methylphenyl)-1-quinolin-5-ylmethanamine?
N-methyl-1-(3-methylphenyl)-1-quinolin-5-ylmethanamine has a molecular weight of 262.36 g/mol, XLogP of 3.85, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(3-methylphenyl)-1-quinolin-5-ylmethanamine is sourced from PubChem (CID 81220394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).