6-(3,5-dichloro-4-pyridinyl)hexan-1-ol

C11H15Cl2NO — CID 10562476

IUPAC6-(3,5-dichloro-4-pyridinyl)hexan-1-ol
SMILESOCCCCCCc1c(Cl)cncc1Cl
InChIInChI=1S/C11H15Cl2NO/c12-10-7-14-8-11(13)9(10)5-3-1-2-4-6-15/h7-8,15H,1-6H2
InChIKeyJCHZVIUMMIGJAA-UHFFFAOYSA-N
MW248.15 g/mol
LogP3.48
Rot. Bonds6

About 6-(3,5-dichloro-4-pyridinyl)hexan-1-ol

6-(3,5-dichloro-4-pyridinyl)hexan-1-ol (PubChem CID 10562476) has the molecular formula C11H15Cl2NO and a molecular weight of 248.15 g/mol. Its IUPAC name is 6-(3,5-dichloro-4-pyridinyl)hexan-1-ol.

Molecular Properties

Compound Name6-(3,5-dichloro-4-pyridinyl)hexan-1-ol
PubChem CID10562476
Molecular FormulaC11H15Cl2NO
Molecular Weight248.15 g/mol
Exact Mass247.05
IUPAC Name6-(3,5-dichloro-4-pyridinyl)hexan-1-ol
SMILESOCCCCCCc1c(Cl)cncc1Cl
InChIInChI=1S/C11H15Cl2NO/c12-10-7-14-8-11(13)9(10)5-3-1-2-4-6-15/h7-8,15H,1-6H2
InChIKeyJCHZVIUMMIGJAA-UHFFFAOYSA-N
XLogP3.48
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.15
LogP ≤ 53.48
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

4-Pyridinepentanol
CID 642809
3-Pyridinepentanol
CID 642810
3-(6-Chloropyridin-3-yl)propan-1-ol
CID 14071569
2-(6-Chloropyridin-3-yl)ethan-1-ol
CID 14071572
2-(2-Chloropyridin-3-yl)ethan-1-ol
CID 60099269
2-(3-Chloro-5-(trifluoromethyl)pyridin-2-yl)ethanol
CID 117967883
3-(3,5-Dichloropyridin-4-yl)propanoic acid
CID 84685281
3-Amino-3-(5-chloro-2-fluoropyridin-3-yl)propan-1-ol
CID 129942382
(3-Chloropyridin-4-YL)(phenyl)methanol
CID 12602202
(3,5-Dichloropyridin-4-yl)methanol
CID 17855219
3-Amino-2-[(3-chloropyridin-4-yl)methyl]propan-1-ol
CID 65682331
2-(4-Chloro-5-fluoro-3-methylpyridin-2-yl)-2-cyclopropylethan-1-ol
CID 10704610

Frequently Asked Questions

What is the IUPAC name of 6-(3,5-dichloro-4-pyridinyl)hexan-1-ol?
The IUPAC name of 6-(3,5-dichloro-4-pyridinyl)hexan-1-ol (CID 10562476) is 6-(3,5-dichloro-4-pyridinyl)hexan-1-ol.
What is the SMILES notation for 6-(3,5-dichloro-4-pyridinyl)hexan-1-ol?
The canonical SMILES for 6-(3,5-dichloro-4-pyridinyl)hexan-1-ol is OCCCCCCc1c(Cl)cncc1Cl.
What is the InChIKey of 6-(3,5-dichloro-4-pyridinyl)hexan-1-ol?
The InChIKey is JCHZVIUMMIGJAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15Cl2NO/c12-10-7-14-8-11(13)9(10)5-3-1-2-4-6-15/h7-8,15H,1-6H2.
What are the key properties of 6-(3,5-dichloro-4-pyridinyl)hexan-1-ol?
6-(3,5-dichloro-4-pyridinyl)hexan-1-ol has a molecular weight of 248.15 g/mol, XLogP of 3.48, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,5-dichloro-4-pyridinyl)hexan-1-ol is sourced from PubChem (CID 10562476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).