1-(5,6,7,8-tetrahydroquinolin-8-yl)hexan-1-amine

C15H24N2 — CID 105007437

IUPAC1-(5,6,7,8-tetrahydroquinolin-8-yl)hexan-1-amine
SMILESCCCCCC(N)C1CCCc2cccnc21
InChIInChI=1S/C15H24N2/c1-2-3-4-10-14(16)13-9-5-7-12-8-6-11-17-15(12)13/h6,8,11,13-14H,2-5,7,9-10,16H2,1H3
InChIKeyKKSCEMXHRCIRLG-UHFFFAOYSA-N
MW232.37 g/mol
LogP3.41
Rot. Bonds5

About 1-(5,6,7,8-tetrahydroquinolin-8-yl)hexan-1-amine

1-(5,6,7,8-tetrahydroquinolin-8-yl)hexan-1-amine (PubChem CID 105007437) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 1-(5,6,7,8-tetrahydroquinolin-8-yl)hexan-1-amine.

Molecular Properties

Compound Name1-(5,6,7,8-tetrahydroquinolin-8-yl)hexan-1-amine
PubChem CID105007437
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name1-(5,6,7,8-tetrahydroquinolin-8-yl)hexan-1-amine
SMILESCCCCCC(N)C1CCCc2cccnc21
InChIInChI=1S/C15H24N2/c1-2-3-4-10-14(16)13-9-5-7-12-8-6-11-17-15(12)13/h6,8,11,13-14H,2-5,7,9-10,16H2,1H3
InChIKeyKKSCEMXHRCIRLG-UHFFFAOYSA-N
XLogP3.41
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-(5,6,7,8-tetrahydroquinolin-8-yl)butan-1-amine
CID 79748417
1-(5,6,7,8-tetrahydroquinolin-8-yl)hexylhydrazine
CID 105320905
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)butan-1-amine
CID 79748418
8-pentan-2-yl-5,6,7,8-tetrahydroquinoline
CID 67125718
N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)pentan-1-amine
CID 79748892
1-(1,2,3,4-tetrahydronaphthalen-1-yl)decan-1-amine
CID 63418547
(8R)-8-propan-2-yl-5,6,7,8-tetrahydroquinoline
CID 58752937
2-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine
CID 81021345
8-butan-2-yl-5,6,7,8-tetrahydroquinoline;8-pentan-2-yl-5,6,7,8-tetrahydroquinoline;8-pentan-3-yl-5,6,7,8-tetrahydroquinoline
CID 67126899
2-ethoxy-2-ethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)butan-1-amine
CID 116759628
N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine
CID 79748588
5,6,7,8-tetrahydroquinolin-8-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine
CID 105007390

Frequently Asked Questions

What is the IUPAC name of 1-(5,6,7,8-tetrahydroquinolin-8-yl)hexan-1-amine?
The IUPAC name of 1-(5,6,7,8-tetrahydroquinolin-8-yl)hexan-1-amine (CID 105007437) is 1-(5,6,7,8-tetrahydroquinolin-8-yl)hexan-1-amine.
What is the SMILES notation for 1-(5,6,7,8-tetrahydroquinolin-8-yl)hexan-1-amine?
The canonical SMILES for 1-(5,6,7,8-tetrahydroquinolin-8-yl)hexan-1-amine is CCCCCC(N)C1CCCc2cccnc21.
What is the InChIKey of 1-(5,6,7,8-tetrahydroquinolin-8-yl)hexan-1-amine?
The InChIKey is KKSCEMXHRCIRLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-2-3-4-10-14(16)13-9-5-7-12-8-6-11-17-15(12)13/h6,8,11,13-14H,2-5,7,9-10,16H2,1H3.
What are the key properties of 1-(5,6,7,8-tetrahydroquinolin-8-yl)hexan-1-amine?
1-(5,6,7,8-tetrahydroquinolin-8-yl)hexan-1-amine has a molecular weight of 232.37 g/mol, XLogP of 3.41, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5,6,7,8-tetrahydroquinolin-8-yl)hexan-1-amine is sourced from PubChem (CID 105007437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).