[4-chloro-6-(hydroxymethyl)-2-pyridinyl]methanol

C7H8ClNO2 — CID 10725891

IUPAC[4-chloro-6-(hydroxymethyl)-2-pyridinyl]methanol
SMILESOCc1cc(Cl)cc(CO)n1
InChIInChI=1S/C7H8ClNO2/c8-5-1-6(3-10)9-7(2-5)4-11/h1-2,10-11H,3-4H2
InChIKeyKNVOMOMGVSFATE-UHFFFAOYSA-N
MW173.60 g/mol
LogP0.72
Rot. Bonds2

About [4-chloro-6-(hydroxymethyl)-2-pyridinyl]methanol

[4-chloro-6-(hydroxymethyl)-2-pyridinyl]methanol (PubChem CID 10725891) has the molecular formula C7H8ClNO2 and a molecular weight of 173.60 g/mol. Its IUPAC name is [4-chloro-6-(hydroxymethyl)-2-pyridinyl]methanol.

Molecular Properties

Compound Name[4-chloro-6-(hydroxymethyl)-2-pyridinyl]methanol
PubChem CID10725891
Molecular FormulaC7H8ClNO2
Molecular Weight173.60 g/mol
Exact Mass173.02
IUPAC Name[4-chloro-6-(hydroxymethyl)-2-pyridinyl]methanol
SMILESOCc1cc(Cl)cc(CO)n1
InChIInChI=1S/C7H8ClNO2/c8-5-1-6(3-10)9-7(2-5)4-11/h1-2,10-11H,3-4H2
InChIKeyKNVOMOMGVSFATE-UHFFFAOYSA-N
XLogP0.72
TPSA53.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.60
LogP ≤ 50.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [4-chloro-6-(hydroxymethyl)-2-pyridinyl]methanol?
The IUPAC name of [4-chloro-6-(hydroxymethyl)-2-pyridinyl]methanol (CID 10725891) is [4-chloro-6-(hydroxymethyl)-2-pyridinyl]methanol.
What is the SMILES notation for [4-chloro-6-(hydroxymethyl)-2-pyridinyl]methanol?
The canonical SMILES for [4-chloro-6-(hydroxymethyl)-2-pyridinyl]methanol is OCc1cc(Cl)cc(CO)n1.
What is the InChIKey of [4-chloro-6-(hydroxymethyl)-2-pyridinyl]methanol?
The InChIKey is KNVOMOMGVSFATE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8ClNO2/c8-5-1-6(3-10)9-7(2-5)4-11/h1-2,10-11H,3-4H2.
What are the key properties of [4-chloro-6-(hydroxymethyl)-2-pyridinyl]methanol?
[4-chloro-6-(hydroxymethyl)-2-pyridinyl]methanol has a molecular weight of 173.60 g/mol, XLogP of 0.72, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-chloro-6-(hydroxymethyl)-2-pyridinyl]methanol is sourced from PubChem (CID 10725891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).