3,5-dimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)cyclohexan-1-amine

C17H26N2 — CID 79745397

IUPAC3,5-dimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)cyclohexan-1-amine
SMILESCC1CC(C)CC(N)(C2CCCc3cccnc32)C1
InChIInChI=1S/C17H26N2/c1-12-9-13(2)11-17(18,10-12)15-7-3-5-14-6-4-8-19-16(14)15/h4,6,8,12-13,15H,3,5,7,9-11,18H2,1-2H3
InChIKeyCHTNIUUUSSYQJH-UHFFFAOYSA-N
MW258.41 g/mol
LogP3.66
Rot. Bonds1

About 3,5-dimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)cyclohexan-1-amine

3,5-dimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)cyclohexan-1-amine (PubChem CID 79745397) has the molecular formula C17H26N2 and a molecular weight of 258.41 g/mol. Its IUPAC name is 3,5-dimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)cyclohexan-1-amine.

Molecular Properties

Compound Name3,5-dimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)cyclohexan-1-amine
PubChem CID79745397
Molecular FormulaC17H26N2
Molecular Weight258.41 g/mol
Exact Mass258.21
IUPAC Name3,5-dimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)cyclohexan-1-amine
SMILESCC1CC(C)CC(N)(C2CCCc3cccnc32)C1
InChIInChI=1S/C17H26N2/c1-12-9-13(2)11-17(18,10-12)15-7-3-5-14-6-4-8-19-16(14)15/h4,6,8,12-13,15H,3,5,7,9-11,18H2,1-2H3
InChIKeyCHTNIUUUSSYQJH-UHFFFAOYSA-N
XLogP3.66
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3,5-dimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)cyclohexan-1-amine with MolForge

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Related Compounds

1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-4,4-dimethylcyclohexan-1-amine
CID 79745639
(8S)-5,6,7,8-tetrahydroquinolin-8-amine
CID 12031071
3-cyclopropyl-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)cyclohexan-1-amine
CID 79745147
8-(3-chloro-1-methylcyclopentyl)-5,6,7,8-tetrahydroquinoline
CID 116540409
(8R)-8-propan-2-yl-5,6,7,8-tetrahydroquinoline
CID 58752937
1-(5,6,7,8-tetrahydroquinolin-8-yl)cyclohexan-1-ol
CID 79739365
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-4-propan-2-ylcyclohexan-1-amine
CID 79745794
(8S)-8-fluoro-5,6,7,8-tetrahydroquinoline
CID 164583093
(8R)-8-fluoro-5,6,7,8-tetrahydroquinoline
CID 162400504
5,6,7,8-tetrahydroquinolin-8-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine
CID 105007390
1-(5,6,7,8-tetrahydroquinolin-8-yl)-3,4-dihydro-2H-naphthalen-1-ol
CID 79723609
trimethyl(5,6,7,8-tetrahydroquinolin-8-yl)silane
CID 130535889

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)cyclohexan-1-amine?
The IUPAC name of 3,5-dimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)cyclohexan-1-amine (CID 79745397) is 3,5-dimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)cyclohexan-1-amine.
What is the SMILES notation for 3,5-dimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)cyclohexan-1-amine?
The canonical SMILES for 3,5-dimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)cyclohexan-1-amine is CC1CC(C)CC(N)(C2CCCc3cccnc32)C1.
What is the InChIKey of 3,5-dimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)cyclohexan-1-amine?
The InChIKey is CHTNIUUUSSYQJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2/c1-12-9-13(2)11-17(18,10-12)15-7-3-5-14-6-4-8-19-16(14)15/h4,6,8,12-13,15H,3,5,7,9-11,18H2,1-2H3.
What are the key properties of 3,5-dimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)cyclohexan-1-amine?
3,5-dimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)cyclohexan-1-amine has a molecular weight of 258.41 g/mol, XLogP of 3.66, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)cyclohexan-1-amine is sourced from PubChem (CID 79745397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).