2-propyl-1-quinolin-6-ylpentan-1-ol

C17H23NO — CID 115826786

IUPAC2-propyl-1-quinolin-6-ylpentan-1-ol
SMILESCCCC(CCC)C(O)c1ccc2ncccc2c1
InChIInChI=1S/C17H23NO/c1-3-6-13(7-4-2)17(19)15-9-10-16-14(12-15)8-5-11-18-16/h5,8-13,17,19H,3-4,6-7H2,1-2H3
InChIKeyGJRKUJZEHISTRY-UHFFFAOYSA-N
MW257.38 g/mol
LogP4.48
Rot. Bonds6

About 2-propyl-1-quinolin-6-ylpentan-1-ol

2-propyl-1-quinolin-6-ylpentan-1-ol (PubChem CID 115826786) has the molecular formula C17H23NO and a molecular weight of 257.38 g/mol. Its IUPAC name is 2-propyl-1-quinolin-6-ylpentan-1-ol.

Molecular Properties

Compound Name2-propyl-1-quinolin-6-ylpentan-1-ol
PubChem CID115826786
Molecular FormulaC17H23NO
Molecular Weight257.38 g/mol
Exact Mass257.18
IUPAC Name2-propyl-1-quinolin-6-ylpentan-1-ol
SMILESCCCC(CCC)C(O)c1ccc2ncccc2c1
InChIInChI=1S/C17H23NO/c1-3-6-13(7-4-2)17(19)15-9-10-16-14(12-15)8-5-11-18-16/h5,8-13,17,19H,3-4,6-7H2,1-2H3
InChIKeyGJRKUJZEHISTRY-UHFFFAOYSA-N
XLogP4.48
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.38
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-quinolin-6-ylbutane-1,2-diol
CID 103454747
1-quinolin-6-ylbutan-1-amine
CID 63095616
6-oct-5-en-4-ylquinoline
CID 170319813
ethyl 3,4-dihydroxy-4-quinolin-6-ylbutanoate
CID 171897595
(4-ethylphenyl)-quinolin-6-ylmethanol
CID 62876415
1-quinolin-6-yldecan-1-amine
CID 63418413
2-[hydroxy(quinolin-6-yl)methyl]-3-methylbutanoic acid
CID 63973005
2-[hydroxy(quinolin-6-yl)methyl]-2-methylbutanenitrile
CID 79133168
6-(3-quinolin-6-ylbutan-2-yl)quinoline
CID 20658775
[(2S)-2-hydroxy-2-quinolin-6-ylethyl]azanium
CID 7016270
ethyl (2R)-2-quinolin-6-ylpropanoate
CID 86328869
methyl 2,3-dihydroxy-3-quinolin-6-ylpropanoate
CID 171864271

Frequently Asked Questions

What is the IUPAC name of 2-propyl-1-quinolin-6-ylpentan-1-ol?
The IUPAC name of 2-propyl-1-quinolin-6-ylpentan-1-ol (CID 115826786) is 2-propyl-1-quinolin-6-ylpentan-1-ol.
What is the SMILES notation for 2-propyl-1-quinolin-6-ylpentan-1-ol?
The canonical SMILES for 2-propyl-1-quinolin-6-ylpentan-1-ol is CCCC(CCC)C(O)c1ccc2ncccc2c1.
What is the InChIKey of 2-propyl-1-quinolin-6-ylpentan-1-ol?
The InChIKey is GJRKUJZEHISTRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23NO/c1-3-6-13(7-4-2)17(19)15-9-10-16-14(12-15)8-5-11-18-16/h5,8-13,17,19H,3-4,6-7H2,1-2H3.
What are the key properties of 2-propyl-1-quinolin-6-ylpentan-1-ol?
2-propyl-1-quinolin-6-ylpentan-1-ol has a molecular weight of 257.38 g/mol, XLogP of 4.48, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propyl-1-quinolin-6-ylpentan-1-ol is sourced from PubChem (CID 115826786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).