[3-(5-chloro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methanol

C10H9ClN2O2 — CID 67157504

IUPAC[3-(5-chloro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methanol
SMILESCc1onc(-c2ccc(Cl)cn2)c1CO
InChIInChI=1S/C10H9ClN2O2/c1-6-8(5-14)10(13-15-6)9-3-2-7(11)4-12-9/h2-4,14H,5H2,1H3
InChIKeyQICWAQBWQWWPNN-UHFFFAOYSA-N
MW224.65 g/mol
LogP2.19
Rot. Bonds2

About [3-(5-chloro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methanol

[3-(5-chloro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methanol (PubChem CID 67157504) has the molecular formula C10H9ClN2O2 and a molecular weight of 224.65 g/mol. Its IUPAC name is [3-(5-chloro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methanol.

Molecular Properties

Compound Name[3-(5-chloro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methanol
PubChem CID67157504
Molecular FormulaC10H9ClN2O2
Molecular Weight224.65 g/mol
Exact Mass224.04
IUPAC Name[3-(5-chloro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methanol
SMILESCc1onc(-c2ccc(Cl)cn2)c1CO
InChIInChI=1S/C10H9ClN2O2/c1-6-8(5-14)10(13-15-6)9-3-2-7(11)4-12-9/h2-4,14H,5H2,1H3
InChIKeyQICWAQBWQWWPNN-UHFFFAOYSA-N
XLogP2.19
TPSA59.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.65
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [3-(5-chloro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methanol?
The IUPAC name of [3-(5-chloro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methanol (CID 67157504) is [3-(5-chloro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methanol.
What is the SMILES notation for [3-(5-chloro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methanol?
The canonical SMILES for [3-(5-chloro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methanol is Cc1onc(-c2ccc(Cl)cn2)c1CO.
What is the InChIKey of [3-(5-chloro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methanol?
The InChIKey is QICWAQBWQWWPNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClN2O2/c1-6-8(5-14)10(13-15-6)9-3-2-7(11)4-12-9/h2-4,14H,5H2,1H3.
What are the key properties of [3-(5-chloro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methanol?
[3-(5-chloro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methanol has a molecular weight of 224.65 g/mol, XLogP of 2.19, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(5-chloro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methanol is sourced from PubChem (CID 67157504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).