5-(3,4-dihydro-2H-quinolin-1-yl)pentan-1-ol

C14H21NO — CID 13472126

IUPAC5-(3,4-dihydro-2H-quinolin-1-yl)pentan-1-ol
SMILESOCCCCCN1CCCc2ccccc21
InChIInChI=1S/C14H21NO/c16-12-5-1-4-10-15-11-6-8-13-7-2-3-9-14(13)15/h2-3,7,9,16H,1,4-6,8,10-12H2
InChIKeyYCIWRWGXMNHTHG-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.60
Rot. Bonds5

About 5-(3,4-dihydro-2H-quinolin-1-yl)pentan-1-ol

5-(3,4-dihydro-2H-quinolin-1-yl)pentan-1-ol (PubChem CID 13472126) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 5-(3,4-dihydro-2H-quinolin-1-yl)pentan-1-ol.

Molecular Properties

Compound Name5-(3,4-dihydro-2H-quinolin-1-yl)pentan-1-ol
PubChem CID13472126
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name5-(3,4-dihydro-2H-quinolin-1-yl)pentan-1-ol
SMILESOCCCCCN1CCCc2ccccc21
InChIInChI=1S/C14H21NO/c16-12-5-1-4-10-15-11-6-8-13-7-2-3-9-14(13)15/h2-3,7,9,16H,1,4-6,8,10-12H2
InChIKeyYCIWRWGXMNHTHG-UHFFFAOYSA-N
XLogP2.60
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.60
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-heptyl-3,4-dihydro-2H-quinoline
CID 154324891
6-(3,4-dihydro-2H-quinolin-1-yl)hexan-1-amine
CID 13472128
8-(3,4-dihydro-2H-quinolin-1-yl)octan-1-amine
CID 13472131
2-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)ethanol
CID 15488047
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
5-(7-amino-3,4-dihydro-2H-quinolin-1-yl)pentan-1-ol
CID 55055575
6-(6-amino-3,4-dihydro-2H-quinolin-1-yl)hexan-1-ol
CID 107704010
1-(3-pyrrolidin-1-ylpropyl)-3,4-dihydro-2H-quinoline
CID 82085595
1-(4-hydroxybutyl)-3,4-dihydro-2H-1-benzazepin-5-one
CID 114336953
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

Frequently Asked Questions

What is the IUPAC name of 5-(3,4-dihydro-2H-quinolin-1-yl)pentan-1-ol?
The IUPAC name of 5-(3,4-dihydro-2H-quinolin-1-yl)pentan-1-ol (CID 13472126) is 5-(3,4-dihydro-2H-quinolin-1-yl)pentan-1-ol.
What is the SMILES notation for 5-(3,4-dihydro-2H-quinolin-1-yl)pentan-1-ol?
The canonical SMILES for 5-(3,4-dihydro-2H-quinolin-1-yl)pentan-1-ol is OCCCCCN1CCCc2ccccc21.
What is the InChIKey of 5-(3,4-dihydro-2H-quinolin-1-yl)pentan-1-ol?
The InChIKey is YCIWRWGXMNHTHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c16-12-5-1-4-10-15-11-6-8-13-7-2-3-9-14(13)15/h2-3,7,9,16H,1,4-6,8,10-12H2.
What are the key properties of 5-(3,4-dihydro-2H-quinolin-1-yl)pentan-1-ol?
5-(3,4-dihydro-2H-quinolin-1-yl)pentan-1-ol has a molecular weight of 219.33 g/mol, XLogP of 2.60, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,4-dihydro-2H-quinolin-1-yl)pentan-1-ol is sourced from PubChem (CID 13472126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).