2-[5-methyl-2-(1-pyridin-2-yloxyethyl)-1,3-oxazol-4-yl]ethanol

C13H16N2O3 — CID 67845522

IUPAC2-[5-methyl-2-(1-pyridin-2-yloxyethyl)-1,3-oxazol-4-yl]ethanol
SMILESCc1oc(C(C)Oc2ccccn2)nc1CCO
InChIInChI=1S/C13H16N2O3/c1-9-11(6-8-16)15-13(18-9)10(2)17-12-5-3-4-7-14-12/h3-5,7,10,16H,6,8H2,1-2H3
InChIKeyVAIQOJNFKLSCQE-UHFFFAOYSA-N
MW248.28 g/mol
LogP2.05
Rot. Bonds5

About 2-[5-methyl-2-(1-pyridin-2-yloxyethyl)-1,3-oxazol-4-yl]ethanol

2-[5-methyl-2-(1-pyridin-2-yloxyethyl)-1,3-oxazol-4-yl]ethanol (PubChem CID 67845522) has the molecular formula C13H16N2O3 and a molecular weight of 248.28 g/mol. Its IUPAC name is 2-[5-methyl-2-(1-pyridin-2-yloxyethyl)-1,3-oxazol-4-yl]ethanol.

Molecular Properties

Compound Name2-[5-methyl-2-(1-pyridin-2-yloxyethyl)-1,3-oxazol-4-yl]ethanol
PubChem CID67845522
Molecular FormulaC13H16N2O3
Molecular Weight248.28 g/mol
Exact Mass248.12
IUPAC Name2-[5-methyl-2-(1-pyridin-2-yloxyethyl)-1,3-oxazol-4-yl]ethanol
SMILESCc1oc(C(C)Oc2ccccn2)nc1CCO
InChIInChI=1S/C13H16N2O3/c1-9-11(6-8-16)15-13(18-9)10(2)17-12-5-3-4-7-14-12/h3-5,7,10,16H,6,8H2,1-2H3
InChIKeyVAIQOJNFKLSCQE-UHFFFAOYSA-N
XLogP2.05
TPSA68.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.28
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[2-(2-hydroxyethoxy)ethoxy]ethanol;2-propan-2-yloxypyridine
CID 118647854
5-methyl-2-pentan-3-yl-4-(2-phenoxyethyl)-1,3-oxazole
CID 141088768
2-pentan-3-yloxypyridine
CID 45091035
(2R)-2-pyridin-2-yloxypropan-1-amine
CID 51684255
7-pyridin-2-yloxyheptan-1-ol
CID 22675453
8-pyridin-2-yloxyoctan-1-ol
CID 22675460
4,4,4-trifluoro-3-pyridin-2-yloxybutan-1-ol
CID 177219210
5-methyl-4-[2-[(6-methyl-2-pyridinyl)oxy]ethyl]-2-phenyl-1,3-oxazole
CID 20723570
2-pyridin-2-yloxypropanal
CID 173353438
2-(1-phenoxypropan-2-yloxy)pyridine
CID 67893782
2-[2-(4-propan-2-yloxyphenoxy)ethoxy]pyridine
CID 15764663
(5-methyl-2-pyridin-2-yl-1,3-oxazol-4-yl)methanamine
CID 82281196

Frequently Asked Questions

What is the IUPAC name of 2-[5-methyl-2-(1-pyridin-2-yloxyethyl)-1,3-oxazol-4-yl]ethanol?
The IUPAC name of 2-[5-methyl-2-(1-pyridin-2-yloxyethyl)-1,3-oxazol-4-yl]ethanol (CID 67845522) is 2-[5-methyl-2-(1-pyridin-2-yloxyethyl)-1,3-oxazol-4-yl]ethanol.
What is the SMILES notation for 2-[5-methyl-2-(1-pyridin-2-yloxyethyl)-1,3-oxazol-4-yl]ethanol?
The canonical SMILES for 2-[5-methyl-2-(1-pyridin-2-yloxyethyl)-1,3-oxazol-4-yl]ethanol is Cc1oc(C(C)Oc2ccccn2)nc1CCO.
What is the InChIKey of 2-[5-methyl-2-(1-pyridin-2-yloxyethyl)-1,3-oxazol-4-yl]ethanol?
The InChIKey is VAIQOJNFKLSCQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O3/c1-9-11(6-8-16)15-13(18-9)10(2)17-12-5-3-4-7-14-12/h3-5,7,10,16H,6,8H2,1-2H3.
What are the key properties of 2-[5-methyl-2-(1-pyridin-2-yloxyethyl)-1,3-oxazol-4-yl]ethanol?
2-[5-methyl-2-(1-pyridin-2-yloxyethyl)-1,3-oxazol-4-yl]ethanol has a molecular weight of 248.28 g/mol, XLogP of 2.05, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-methyl-2-(1-pyridin-2-yloxyethyl)-1,3-oxazol-4-yl]ethanol is sourced from PubChem (CID 67845522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).