N-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-ylmethyl)-1-cyclohexyl-N-methylmethanamine

C18H34N2 — CID 66470216

IUPACN-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-ylmethyl)-1-cyclohexyl-N-methylmethanamine
SMILESCN(CC1CCCCC1)CC1CCC2CCCCC2N1
InChIInChI=1S/C18H34N2/c1-20(13-15-7-3-2-4-8-15)14-17-12-11-16-9-5-6-10-18(16)19-17/h15-19H,2-14H2,1H3
InChIKeyILAHDRDIYLPYIV-UHFFFAOYSA-N
MW278.48 g/mol
LogP3.81
Rot. Bonds4

About N-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-ylmethyl)-1-cyclohexyl-N-methylmethanamine

N-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-ylmethyl)-1-cyclohexyl-N-methylmethanamine (PubChem CID 66470216) has the molecular formula C18H34N2 and a molecular weight of 278.48 g/mol. Its IUPAC name is N-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-ylmethyl)-1-cyclohexyl-N-methylmethanamine.

Molecular Properties

Compound NameN-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-ylmethyl)-1-cyclohexyl-N-methylmethanamine
PubChem CID66470216
Molecular FormulaC18H34N2
Molecular Weight278.48 g/mol
Exact Mass278.27
IUPAC NameN-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-ylmethyl)-1-cyclohexyl-N-methylmethanamine
SMILESCN(CC1CCCCC1)CC1CCC2CCCCC2N1
InChIInChI=1S/C18H34N2/c1-20(13-15-7-3-2-4-8-15)14-17-12-11-16-9-5-6-10-18(16)19-17/h15-19H,2-14H2,1H3
InChIKeyILAHDRDIYLPYIV-UHFFFAOYSA-N
XLogP3.81
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.48
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-ylmethyl)-1-cyclohexyl-N-methylmethanamine 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-Methyldecahydroquinoline (mixture of isomers)
CID 524016
(2S,3S)-2-((R)-4-(3-cyclohexylpropyl)-3-isopropylpiperazin-1-yl)-N,3-dimethylpentan-1-amine
CID 45482257
Tetradecahydroacridine
CID 140130
5-Methyl-5-azabicyclo[4.4.0]dec-2-ylamine
CID 4912809
rac-(4aR,8aR)-1-(piperidin-3-yl)-decahydroquinoline
CID 102726527
1-cyclohexyl-N-(2-piperidin-1-ylethyl)pentan-2-amine
CID 172451235
Diethylenetriamine, 1,7-bis(2'-methylcyclohexyl)-
CID 23423563
cyclohexane, [N-cyclohexylmethyl-N-[2-(N-methyl)piperidinium]ethyl]amino-
CID 171384334
cyclohexane, [N-cyclohexylmethyl-N-[2-(N-methyl)piperidinium]ethyl]aminomethyl-
CID 171384523
9-Methylperhydroacridine
CID 129781956
2-methyl-N-(2-piperidin-1-ylethyl)cyclohexan-1-amine
CID 60688929
2-cyclohexyl-N-[1-(4-methylpiperazin-1-yl)propan-2-yl]cyclohexan-1-amine
CID 75428008

Frequently Asked Questions

What is the IUPAC name of N-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-ylmethyl)-1-cyclohexyl-N-methylmethanamine?
The IUPAC name of N-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-ylmethyl)-1-cyclohexyl-N-methylmethanamine (CID 66470216) is N-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-ylmethyl)-1-cyclohexyl-N-methylmethanamine.
What is the SMILES notation for N-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-ylmethyl)-1-cyclohexyl-N-methylmethanamine?
The canonical SMILES for N-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-ylmethyl)-1-cyclohexyl-N-methylmethanamine is CN(CC1CCCCC1)CC1CCC2CCCCC2N1.
What is the InChIKey of N-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-ylmethyl)-1-cyclohexyl-N-methylmethanamine?
The InChIKey is ILAHDRDIYLPYIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34N2/c1-20(13-15-7-3-2-4-8-15)14-17-12-11-16-9-5-6-10-18(16)19-17/h15-19H,2-14H2,1H3.
What are the key properties of N-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-ylmethyl)-1-cyclohexyl-N-methylmethanamine?
N-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-ylmethyl)-1-cyclohexyl-N-methylmethanamine has a molecular weight of 278.48 g/mol, XLogP of 3.81, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-2-ylmethyl)-1-cyclohexyl-N-methylmethanamine is sourced from PubChem (CID 66470216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).