1-(3,4-dihydro-2H-pyran-6-yl)nonan-1-ol

C14H26O2 — CID 102649817

IUPAC1-(3,4-dihydro-2H-pyran-6-yl)nonan-1-ol
SMILESCCCCCCCCC(O)C1=CCCCO1
InChIInChI=1S/C14H26O2/c1-2-3-4-5-6-7-10-13(15)14-11-8-9-12-16-14/h11,13,15H,2-10,12H2,1H3
InChIKeyIAADOOXYLUFJSE-UHFFFAOYSA-N
MW226.36 g/mol
LogP3.79
Rot. Bonds8

About 1-(3,4-dihydro-2H-pyran-6-yl)nonan-1-ol

1-(3,4-dihydro-2H-pyran-6-yl)nonan-1-ol (PubChem CID 102649817) has the molecular formula C14H26O2 and a molecular weight of 226.36 g/mol. Its IUPAC name is 1-(3,4-dihydro-2H-pyran-6-yl)nonan-1-ol.

Molecular Properties

Compound Name1-(3,4-dihydro-2H-pyran-6-yl)nonan-1-ol
PubChem CID102649817
Molecular FormulaC14H26O2
Molecular Weight226.36 g/mol
Exact Mass226.19
IUPAC Name1-(3,4-dihydro-2H-pyran-6-yl)nonan-1-ol
SMILESCCCCCCCCC(O)C1=CCCCO1
InChIInChI=1S/C14H26O2/c1-2-3-4-5-6-7-10-13(15)14-11-8-9-12-16-14/h11,13,15H,2-10,12H2,1H3
InChIKeyIAADOOXYLUFJSE-UHFFFAOYSA-N
XLogP3.79
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 53.79
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-(3,4-dihydro-2H-pyran-6-yl)octan-1-ol
CID 102646548
1-(3,4-dihydro-2H-pyran-6-yl)-3-methylsulfanylpropan-1-ol
CID 102646549
(4-butylcyclohexyl)-(3,4-dihydro-2H-pyran-6-yl)methanol
CID 102649753
2-(4-tert-butyl-2,6-dimethylphenyl)-1-(3,4-dihydro-2H-pyran-6-yl)ethanol
CID 102654604
1-(cyclopenten-1-yl)hexan-1-ol
CID 62078915
2-cyclohexyl-1-(3,4-dihydro-2H-pyran-6-yl)ethanol
CID 102646644
1-(3,4-dihydro-2H-pyran-6-yl)-3-(3-methylphenoxy)propan-1-ol
CID 102649671
1-(3,4-dihydro-2H-pyran-6-yl)-3-pyridin-2-ylpropan-1-ol
CID 102649748
1-(2,3-dihydrofuran-5-yl)-N-ethyldodecan-1-amine
CID 102653271
1-(2,3-dihydrofuran-5-yl)pentan-1-amine
CID 102651898
1-(3,4-dihydro-2H-pyran-6-yl)-3-methylbutane-1,2-diol
CID 103456632
1-(3,4-dihydro-2H-pyran-6-yl)-2-ethoxybutan-1-ol
CID 102654872

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dihydro-2H-pyran-6-yl)nonan-1-ol?
The IUPAC name of 1-(3,4-dihydro-2H-pyran-6-yl)nonan-1-ol (CID 102649817) is 1-(3,4-dihydro-2H-pyran-6-yl)nonan-1-ol.
What is the SMILES notation for 1-(3,4-dihydro-2H-pyran-6-yl)nonan-1-ol?
The canonical SMILES for 1-(3,4-dihydro-2H-pyran-6-yl)nonan-1-ol is CCCCCCCCC(O)C1=CCCCO1.
What is the InChIKey of 1-(3,4-dihydro-2H-pyran-6-yl)nonan-1-ol?
The InChIKey is IAADOOXYLUFJSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26O2/c1-2-3-4-5-6-7-10-13(15)14-11-8-9-12-16-14/h11,13,15H,2-10,12H2,1H3.
What are the key properties of 1-(3,4-dihydro-2H-pyran-6-yl)nonan-1-ol?
1-(3,4-dihydro-2H-pyran-6-yl)nonan-1-ol has a molecular weight of 226.36 g/mol, XLogP of 3.79, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-dihydro-2H-pyran-6-yl)nonan-1-ol is sourced from PubChem (CID 102649817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).