1-(2-methylquinolin-8-yl)hexan-1-ol

C16H21NO — CID 102243588

IUPAC1-(2-methylquinolin-8-yl)hexan-1-ol
SMILESCCCCCC(O)c1cccc2ccc(C)nc12
InChIInChI=1S/C16H21NO/c1-3-4-5-9-15(18)14-8-6-7-13-11-10-12(2)17-16(13)14/h6-8,10-11,15,18H,3-5,9H2,1-2H3
InChIKeyIVXNCLUVEHXJKT-UHFFFAOYSA-N
MW243.35 g/mol
LogP4.16
Rot. Bonds5

About 1-(2-methylquinolin-8-yl)hexan-1-ol

1-(2-methylquinolin-8-yl)hexan-1-ol (PubChem CID 102243588) has the molecular formula C16H21NO and a molecular weight of 243.35 g/mol. Its IUPAC name is 1-(2-methylquinolin-8-yl)hexan-1-ol.

Molecular Properties

Compound Name1-(2-methylquinolin-8-yl)hexan-1-ol
PubChem CID102243588
Molecular FormulaC16H21NO
Molecular Weight243.35 g/mol
Exact Mass243.16
IUPAC Name1-(2-methylquinolin-8-yl)hexan-1-ol
SMILESCCCCCC(O)c1cccc2ccc(C)nc12
InChIInChI=1S/C16H21NO/c1-3-4-5-9-15(18)14-8-6-7-13-11-10-12(2)17-16(13)14/h6-8,10-11,15,18H,3-5,9H2,1-2H3
InChIKeyIVXNCLUVEHXJKT-UHFFFAOYSA-N
XLogP4.16
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 54.16
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-(2,6-dimethyl-3-pyridinyl)hexan-1-ol
CID 105086146
1-(2,6-dimethyl-3-pyridinyl)nonan-1-ol
CID 105085795
1-(2,6-dimethyl-3-pyridinyl)pentan-1-ol
CID 105085207
1-(7-bromonaphthalen-1-yl)hexan-1-ol
CID 102243585
1-(2,3-dimethylphenyl)octan-1-ol
CID 63900365
1-(2-fluoro-3-methylphenyl)undecan-1-ol
CID 115789168
ethane;bis(2-methylquinolin-8-ol);propane;hydrate
CID 143591758
1-(2-methylsulfanylphenyl)heptan-1-ol
CID 115783455
1-(2-chlorophenyl)hexan-1-ol
CID 62606389
CID 6371660
CID 6371660
CID 66916636
CID 66916636
1-(6-methyl-2-pyridinyl)undec-1-en-3-ol
CID 71344919

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylquinolin-8-yl)hexan-1-ol?
The IUPAC name of 1-(2-methylquinolin-8-yl)hexan-1-ol (CID 102243588) is 1-(2-methylquinolin-8-yl)hexan-1-ol.
What is the SMILES notation for 1-(2-methylquinolin-8-yl)hexan-1-ol?
The canonical SMILES for 1-(2-methylquinolin-8-yl)hexan-1-ol is CCCCCC(O)c1cccc2ccc(C)nc12.
What is the InChIKey of 1-(2-methylquinolin-8-yl)hexan-1-ol?
The InChIKey is IVXNCLUVEHXJKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21NO/c1-3-4-5-9-15(18)14-8-6-7-13-11-10-12(2)17-16(13)14/h6-8,10-11,15,18H,3-5,9H2,1-2H3.
What are the key properties of 1-(2-methylquinolin-8-yl)hexan-1-ol?
1-(2-methylquinolin-8-yl)hexan-1-ol has a molecular weight of 243.35 g/mol, XLogP of 4.16, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylquinolin-8-yl)hexan-1-ol is sourced from PubChem (CID 102243588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).