1-(3,5-dimethylcyclohexyl)-N-methyl-1-quinolin-6-ylmethanamine

C19H26N2 — CID 64729922

IUPAC1-(3,5-dimethylcyclohexyl)-N-methyl-1-quinolin-6-ylmethanamine
SMILESCNC(c1ccc2ncccc2c1)C1CC(C)CC(C)C1
InChIInChI=1S/C19H26N2/c1-13-9-14(2)11-17(10-13)19(20-3)16-6-7-18-15(12-16)5-4-8-21-18/h4-8,12-14,17,19-20H,9-11H2,1-3H3
InChIKeyGMEPOLADNMJQRR-UHFFFAOYSA-N
MW282.43 g/mol
LogP4.57
Rot. Bonds3

About 1-(3,5-dimethylcyclohexyl)-N-methyl-1-quinolin-6-ylmethanamine

1-(3,5-dimethylcyclohexyl)-N-methyl-1-quinolin-6-ylmethanamine (PubChem CID 64729922) has the molecular formula C19H26N2 and a molecular weight of 282.43 g/mol. Its IUPAC name is 1-(3,5-dimethylcyclohexyl)-N-methyl-1-quinolin-6-ylmethanamine.

Molecular Properties

Compound Name1-(3,5-dimethylcyclohexyl)-N-methyl-1-quinolin-6-ylmethanamine
PubChem CID64729922
Molecular FormulaC19H26N2
Molecular Weight282.43 g/mol
Exact Mass282.21
IUPAC Name1-(3,5-dimethylcyclohexyl)-N-methyl-1-quinolin-6-ylmethanamine
SMILESCNC(c1ccc2ncccc2c1)C1CC(C)CC(C)C1
InChIInChI=1S/C19H26N2/c1-13-9-14(2)11-17(10-13)19(20-3)16-6-7-18-15(12-16)5-4-8-21-18/h4-8,12-14,17,19-20H,9-11H2,1-3H3
InChIKeyGMEPOLADNMJQRR-UHFFFAOYSA-N
XLogP4.57
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-1-(4-methylcyclohexyl)-1-quinolin-6-ylmethanamine
CID 64776674
1-cyclooctyl-N-methyl-1-quinolin-7-ylmethanamine
CID 81229901
N-methyl-1-quinolin-6-ylpropan-1-amine
CID 63095975
1-(1,4-dimethylpiperazin-2-yl)-N-methyl-1-quinolin-6-ylmethanamine
CID 81229525
[cyclopentyl(quinolin-6-yl)methyl]hydrazine
CID 105204471
1-(3-ethylcyclopentyl)-N-methyl-1-quinolin-7-ylmethanamine
CID 81231705
2-(3-ethoxycyclobutyl)-N-methyl-1-quinolin-6-ylethanamine
CID 103169272
N-methyl-1-quinolin-7-yl-1-(thiolan-3-yl)methanamine
CID 105172644
6-(3-quinolin-6-ylbutan-2-yl)quinoline
CID 20658775
N-[cyclohexyl(quinolin-6-yl)methyl]propan-1-amine
CID 63095807
cyclopropyl(quinolin-6-yl)methanamine
CID 55273103
N-[(3-methylcyclopentyl)-quinolin-7-ylmethyl]ethanamine
CID 81231066

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-dimethylcyclohexyl)-N-methyl-1-quinolin-6-ylmethanamine?
The IUPAC name of 1-(3,5-dimethylcyclohexyl)-N-methyl-1-quinolin-6-ylmethanamine (CID 64729922) is 1-(3,5-dimethylcyclohexyl)-N-methyl-1-quinolin-6-ylmethanamine.
What is the SMILES notation for 1-(3,5-dimethylcyclohexyl)-N-methyl-1-quinolin-6-ylmethanamine?
The canonical SMILES for 1-(3,5-dimethylcyclohexyl)-N-methyl-1-quinolin-6-ylmethanamine is CNC(c1ccc2ncccc2c1)C1CC(C)CC(C)C1.
What is the InChIKey of 1-(3,5-dimethylcyclohexyl)-N-methyl-1-quinolin-6-ylmethanamine?
The InChIKey is GMEPOLADNMJQRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2/c1-13-9-14(2)11-17(10-13)19(20-3)16-6-7-18-15(12-16)5-4-8-21-18/h4-8,12-14,17,19-20H,9-11H2,1-3H3.
What are the key properties of 1-(3,5-dimethylcyclohexyl)-N-methyl-1-quinolin-6-ylmethanamine?
1-(3,5-dimethylcyclohexyl)-N-methyl-1-quinolin-6-ylmethanamine has a molecular weight of 282.43 g/mol, XLogP of 4.57, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dimethylcyclohexyl)-N-methyl-1-quinolin-6-ylmethanamine is sourced from PubChem (CID 64729922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).