8-(3,4-dihydro-2H-quinolin-1-yl)octan-1-amine

C17H28N2 — CID 13472131

IUPAC8-(3,4-dihydro-2H-quinolin-1-yl)octan-1-amine
SMILESNCCCCCCCCN1CCCc2ccccc21
InChIInChI=1S/C17H28N2/c18-13-7-3-1-2-4-8-14-19-15-9-11-16-10-5-6-12-17(16)19/h5-6,10,12H,1-4,7-9,11,13-15,18H2
InChIKeyNXDDPCIGQGXYQO-UHFFFAOYSA-N
MW260.43 g/mol
LogP3.74
Rot. Bonds8

About 8-(3,4-dihydro-2H-quinolin-1-yl)octan-1-amine

8-(3,4-dihydro-2H-quinolin-1-yl)octan-1-amine (PubChem CID 13472131) has the molecular formula C17H28N2 and a molecular weight of 260.43 g/mol. Its IUPAC name is 8-(3,4-dihydro-2H-quinolin-1-yl)octan-1-amine.

Molecular Properties

Compound Name8-(3,4-dihydro-2H-quinolin-1-yl)octan-1-amine
PubChem CID13472131
Molecular FormulaC17H28N2
Molecular Weight260.43 g/mol
Exact Mass260.23
IUPAC Name8-(3,4-dihydro-2H-quinolin-1-yl)octan-1-amine
SMILESNCCCCCCCCN1CCCc2ccccc21
InChIInChI=1S/C17H28N2/c18-13-7-3-1-2-4-8-14-19-15-9-11-16-10-5-6-12-17(16)19/h5-6,10,12H,1-4,7-9,11,13-15,18H2
InChIKeyNXDDPCIGQGXYQO-UHFFFAOYSA-N
XLogP3.74
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.43
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 8-(3,4-dihydro-2H-quinolin-1-yl)octan-1-amine 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

6-(3,4-dihydro-2H-quinolin-1-yl)hexan-1-amine
CID 13472128
1-heptyl-3,4-dihydro-2H-quinoline
CID 154324891
5-(3,4-dihydro-2H-quinolin-1-yl)pentan-1-ol
CID 13472126
6-(3,4-dihydro-2H-quinolin-1-yl)-N,N-dimethylhexan-1-amine
CID 13472124
8-(3,4-dihydro-2H-quinolin-1-yl)-N,N-dimethyloctan-1-amine
CID 13472133
1-(3-pyrrolidin-1-ylpropyl)-3,4-dihydro-2H-quinoline
CID 82085595
4-(3,4-dihydro-2H-quinolin-1-yl)-N-methylbutan-1-amine
CID 60840995
1-(4-piperazin-1-ylbutyl)-3,4-dihydro-2H-quinoline
CID 28808284
N-[5-(3,4-dihydro-2H-quinolin-1-yl)pentyl]cyclopropanamine
CID 55069946
1-(3-isocyanopropyl)-3,4-dihydro-2H-quinoline
CID 118704588
2-(2,3-dihydroindol-1-yl)ethanamine
CID 1072384
1-(2-pyrrolidin-1-ylethyl)-3,4-dihydro-2H-quinoline
CID 59807075

Frequently Asked Questions

What is the IUPAC name of 8-(3,4-dihydro-2H-quinolin-1-yl)octan-1-amine?
The IUPAC name of 8-(3,4-dihydro-2H-quinolin-1-yl)octan-1-amine (CID 13472131) is 8-(3,4-dihydro-2H-quinolin-1-yl)octan-1-amine.
What is the SMILES notation for 8-(3,4-dihydro-2H-quinolin-1-yl)octan-1-amine?
The canonical SMILES for 8-(3,4-dihydro-2H-quinolin-1-yl)octan-1-amine is NCCCCCCCCN1CCCc2ccccc21.
What is the InChIKey of 8-(3,4-dihydro-2H-quinolin-1-yl)octan-1-amine?
The InChIKey is NXDDPCIGQGXYQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2/c18-13-7-3-1-2-4-8-14-19-15-9-11-16-10-5-6-12-17(16)19/h5-6,10,12H,1-4,7-9,11,13-15,18H2.
What are the key properties of 8-(3,4-dihydro-2H-quinolin-1-yl)octan-1-amine?
8-(3,4-dihydro-2H-quinolin-1-yl)octan-1-amine has a molecular weight of 260.43 g/mol, XLogP of 3.74, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(3,4-dihydro-2H-quinolin-1-yl)octan-1-amine is sourced from PubChem (CID 13472131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).