1-quinolin-8-ylhexan-1-amine

C15H20N2 — CID 105021327

IUPAC1-quinolin-8-ylhexan-1-amine
SMILESCCCCCC(N)c1cccc2cccnc12
InChIInChI=1S/C15H20N2/c1-2-3-4-10-14(16)13-9-5-7-12-8-6-11-17-15(12)13/h5-9,11,14H,2-4,10,16H2,1H3
InChIKeyFVRZUGVKAGITND-UHFFFAOYSA-N
MW228.34 g/mol
LogP3.81
Rot. Bonds5

About 1-quinolin-8-ylhexan-1-amine

1-quinolin-8-ylhexan-1-amine (PubChem CID 105021327) has the molecular formula C15H20N2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 1-quinolin-8-ylhexan-1-amine.

Molecular Properties

Compound Name1-quinolin-8-ylhexan-1-amine
PubChem CID105021327
Molecular FormulaC15H20N2
Molecular Weight228.34 g/mol
Exact Mass228.16
IUPAC Name1-quinolin-8-ylhexan-1-amine
SMILESCCCCCC(N)c1cccc2cccnc12
InChIInChI=1S/C15H20N2/c1-2-3-4-10-14(16)13-9-5-7-12-8-6-11-17-15(12)13/h5-9,11,14H,2-4,10,16H2,1H3
InChIKeyFVRZUGVKAGITND-UHFFFAOYSA-N
XLogP3.81
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 53.81
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-quinolin-8-ylbutan-1-amine
CID 79016206
(1R)-1-naphthalen-1-ylhexan-1-amine
CID 171212033
1-(2-methyl-3-pyridinyl)tridecan-1-amine
CID 105138527
(1R)-1-(2-chloro-3-pyridinyl)hexan-1-amine
CID 171198991
(1S)-1-(2-chloro-3-pyridinyl)hexan-1-amine
CID 171218514
1-quinolin-8-ylethane-1,2-diamine
CID 63968089
1-(2-methoxy-3-pyridinyl)octan-1-amine
CID 105124612
(1S)-1-(2-chloro-3-pyridinyl)pentan-1-amine;hydrochloride
CID 171218513
3-amino-3-quinolin-8-ylpropanoic acid
CID 53441937
1-quinolin-6-yldecan-1-amine
CID 63418413
2-(3,5-difluorophenyl)-1-quinolin-8-ylethanamine
CID 81227602
3-[(1R)-1-aminohexyl]benzene-1,2-diol
CID 171200995

Frequently Asked Questions

What is the IUPAC name of 1-quinolin-8-ylhexan-1-amine?
The IUPAC name of 1-quinolin-8-ylhexan-1-amine (CID 105021327) is 1-quinolin-8-ylhexan-1-amine.
What is the SMILES notation for 1-quinolin-8-ylhexan-1-amine?
The canonical SMILES for 1-quinolin-8-ylhexan-1-amine is CCCCCC(N)c1cccc2cccnc12.
What is the InChIKey of 1-quinolin-8-ylhexan-1-amine?
The InChIKey is FVRZUGVKAGITND-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2/c1-2-3-4-10-14(16)13-9-5-7-12-8-6-11-17-15(12)13/h5-9,11,14H,2-4,10,16H2,1H3.
What are the key properties of 1-quinolin-8-ylhexan-1-amine?
1-quinolin-8-ylhexan-1-amine has a molecular weight of 228.34 g/mol, XLogP of 3.81, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-quinolin-8-ylhexan-1-amine is sourced from PubChem (CID 105021327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).