4-ethyl-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)cyclohexan-1-amine

C18H28N2 — CID 80648414

IUPAC4-ethyl-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)cyclohexan-1-amine
SMILESCCC1CCC(NCc2cccc3c2NCCC3)CC1
InChIInChI=1S/C18H28N2/c1-2-14-8-10-17(11-9-14)20-13-16-6-3-5-15-7-4-12-19-18(15)16/h3,5-6,14,17,19-20H,2,4,7-13H2,1H3
InChIKeyRLJGUOBMRKBALR-UHFFFAOYSA-N
MW272.44 g/mol
LogP4.10
Rot. Bonds4

About 4-ethyl-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)cyclohexan-1-amine

4-ethyl-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)cyclohexan-1-amine (PubChem CID 80648414) has the molecular formula C18H28N2 and a molecular weight of 272.44 g/mol. Its IUPAC name is 4-ethyl-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)cyclohexan-1-amine.

Molecular Properties

Compound Name4-ethyl-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)cyclohexan-1-amine
PubChem CID80648414
Molecular FormulaC18H28N2
Molecular Weight272.44 g/mol
Exact Mass272.23
IUPAC Name4-ethyl-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)cyclohexan-1-amine
SMILESCCC1CCC(NCc2cccc3c2NCCC3)CC1
InChIInChI=1S/C18H28N2/c1-2-14-8-10-17(11-9-14)20-13-16-6-3-5-15-7-4-12-19-18(15)16/h3,5-6,14,17,19-20H,2,4,7-13H2,1H3
InChIKeyRLJGUOBMRKBALR-UHFFFAOYSA-N
XLogP4.10
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.44
LogP ≤ 54.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-(1,2,3,4-tetrahydroquinolin-8-ylmethylamino)cyclohexane-1-carboxamide
CID 80649920
4-N-(2,3-dihydro-1H-indol-7-ylmethyl)cyclohexane-1,4-diamine
CID 80648894
N-(2,3-dihydro-1H-indol-7-ylmethyl)cyclohexanamine
CID 80650268
8-(cyclopropylmethyl)-1,2,3,4-tetrahydroquinoline
CID 106779417
N-(2,3-dihydro-1H-indol-7-ylmethyl)-4,4-dimethylcyclohexan-1-amine
CID 80649220
8-[(4-methylcyclohexyl)methyl]-1,2,3,4-tetrahydroquinoline
CID 64774667
2-methoxy-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)cyclopentan-1-amine
CID 80649519
2-cyclobutyl-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)ethanamine
CID 113478618
N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)propan-2-amine
CID 80648504
3-[(1,2,3,4-tetrahydroquinolin-8-ylmethylamino)methyl]cyclobutan-1-ol
CID 80649380
8-(4-ethylcyclohexyl)oxy-1,2,3,4-tetrahydroquinoline
CID 64775069
N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)butan-2-amine
CID 80648821

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)cyclohexan-1-amine?
The IUPAC name of 4-ethyl-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)cyclohexan-1-amine (CID 80648414) is 4-ethyl-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)cyclohexan-1-amine.
What is the SMILES notation for 4-ethyl-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)cyclohexan-1-amine?
The canonical SMILES for 4-ethyl-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)cyclohexan-1-amine is CCC1CCC(NCc2cccc3c2NCCC3)CC1.
What is the InChIKey of 4-ethyl-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)cyclohexan-1-amine?
The InChIKey is RLJGUOBMRKBALR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2/c1-2-14-8-10-17(11-9-14)20-13-16-6-3-5-15-7-4-12-19-18(15)16/h3,5-6,14,17,19-20H,2,4,7-13H2,1H3.
What are the key properties of 4-ethyl-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)cyclohexan-1-amine?
4-ethyl-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)cyclohexan-1-amine has a molecular weight of 272.44 g/mol, XLogP of 4.10, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)cyclohexan-1-amine is sourced from PubChem (CID 80648414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).