1-(2,6-dimethyl-3-pyridinyl)nonan-1-ol

C16H27NO — CID 105085795

IUPAC1-(2,6-dimethyl-3-pyridinyl)nonan-1-ol
SMILESCCCCCCCCC(O)c1ccc(C)nc1C
InChIInChI=1S/C16H27NO/c1-4-5-6-7-8-9-10-16(18)15-12-11-13(2)17-14(15)3/h11-12,16,18H,4-10H2,1-3H3
InChIKeyJGTZKONCNRDCAO-UHFFFAOYSA-N
MW249.40 g/mol
LogP4.48
Rot. Bonds8

About 1-(2,6-dimethyl-3-pyridinyl)nonan-1-ol

1-(2,6-dimethyl-3-pyridinyl)nonan-1-ol (PubChem CID 105085795) has the molecular formula C16H27NO and a molecular weight of 249.40 g/mol. Its IUPAC name is 1-(2,6-dimethyl-3-pyridinyl)nonan-1-ol.

Molecular Properties

Compound Name1-(2,6-dimethyl-3-pyridinyl)nonan-1-ol
PubChem CID105085795
Molecular FormulaC16H27NO
Molecular Weight249.40 g/mol
Exact Mass249.21
IUPAC Name1-(2,6-dimethyl-3-pyridinyl)nonan-1-ol
SMILESCCCCCCCCC(O)c1ccc(C)nc1C
InChIInChI=1S/C16H27NO/c1-4-5-6-7-8-9-10-16(18)15-12-11-13(2)17-14(15)3/h11-12,16,18H,4-10H2,1-3H3
InChIKeyJGTZKONCNRDCAO-UHFFFAOYSA-N
XLogP4.48
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.40
LogP ≤ 54.48
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)pentan-1-ol
CID 105085207
1-(2,6-dimethyl-3-pyridinyl)heptylhydrazine
CID 105293944
1-(2,6-dimethyl-3-pyridinyl)-N-methyloctan-1-amine
CID 105124721
1-(2,6-dimethyl-3-pyridinyl)-N-ethyloctan-1-amine
CID 105124811
1-(2-methylquinolin-8-yl)hexan-1-ol
CID 102243588
1-(2,6-dimethyl-3-pyridinyl)-2-propoxyethanol
CID 105111964
1-(2,6-dimethyl-3-pyridinyl)hex-4-yn-1-ol
CID 105126569
1-(2,6-dimethyl-3-pyridinyl)-N-methylpentan-1-amine
CID 105125315
bis(2,6-dimethyl-3-pyridinyl)methanol
CID 141423650
1-(2,6-dimethyl-3-pyridinyl)-2-ethylbutan-1-ol
CID 105114692
1-(4-methyl-3-pyridinyl)octan-1-ol
CID 66273519

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dimethyl-3-pyridinyl)nonan-1-ol?
The IUPAC name of 1-(2,6-dimethyl-3-pyridinyl)nonan-1-ol (CID 105085795) is 1-(2,6-dimethyl-3-pyridinyl)nonan-1-ol.
What is the SMILES notation for 1-(2,6-dimethyl-3-pyridinyl)nonan-1-ol?
The canonical SMILES for 1-(2,6-dimethyl-3-pyridinyl)nonan-1-ol is CCCCCCCCC(O)c1ccc(C)nc1C.
What is the InChIKey of 1-(2,6-dimethyl-3-pyridinyl)nonan-1-ol?
The InChIKey is JGTZKONCNRDCAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NO/c1-4-5-6-7-8-9-10-16(18)15-12-11-13(2)17-14(15)3/h11-12,16,18H,4-10H2,1-3H3.
What are the key properties of 1-(2,6-dimethyl-3-pyridinyl)nonan-1-ol?
1-(2,6-dimethyl-3-pyridinyl)nonan-1-ol has a molecular weight of 249.40 g/mol, XLogP of 4.48, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-dimethyl-3-pyridinyl)nonan-1-ol is sourced from PubChem (CID 105085795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).