2-(2-propan-2-yloxy-4-pyridinyl)-1,3-oxazole

C11H12N2O2 — CID 123773885

IUPAC2-(2-propan-2-yloxy-4-pyridinyl)-1,3-oxazole
SMILESCC(C)Oc1cc(-c2ncco2)ccn1
InChIInChI=1S/C11H12N2O2/c1-8(2)15-10-7-9(3-4-12-10)11-13-5-6-14-11/h3-8H,1-2H3
InChIKeyNZWLKQQQZREUIM-UHFFFAOYSA-N
MW204.23 g/mol
LogP2.52
Rot. Bonds3

About 2-(2-propan-2-yloxy-4-pyridinyl)-1,3-oxazole

2-(2-propan-2-yloxy-4-pyridinyl)-1,3-oxazole (PubChem CID 123773885) has the molecular formula C11H12N2O2 and a molecular weight of 204.23 g/mol. Its IUPAC name is 2-(2-propan-2-yloxy-4-pyridinyl)-1,3-oxazole.

Molecular Properties

Compound Name2-(2-propan-2-yloxy-4-pyridinyl)-1,3-oxazole
PubChem CID123773885
Molecular FormulaC11H12N2O2
Molecular Weight204.23 g/mol
Exact Mass204.09
IUPAC Name2-(2-propan-2-yloxy-4-pyridinyl)-1,3-oxazole
SMILESCC(C)Oc1cc(-c2ncco2)ccn1
InChIInChI=1S/C11H12N2O2/c1-8(2)15-10-7-9(3-4-12-10)11-13-5-6-14-11/h3-8H,1-2H3
InChIKeyNZWLKQQQZREUIM-UHFFFAOYSA-N
XLogP2.52
TPSA48.15 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-fluoro-3-propan-2-ylphenyl)-1,3-oxazole
CID 58834826
2-[4-(1-bromoethyl)-3-fluorophenyl]-1,3-oxazole
CID 174633441
2-(6-propan-2-yl-3-pyridinyl)-1,3-oxazole
CID 89273799
2-methoxy-4-(1,3-oxazol-2-yl)aniline
CID 82468773
4-[2-(2-propan-2-yloxy-4-pyridinyl)-1,3-thiazol-4-yl]benzonitrile
CID 103597381
4-(4-fluorophenyl)-2-(2-propan-2-yloxy-4-pyridinyl)-1,3-thiazole
CID 103597382
2-(2-propan-2-yloxy-4-pyridinyl)propanoic acid
CID 83884295
2-phenyl-1,3-oxazole;zinc
CID 175242530
2-methyl-5-(1,3-oxazol-2-yl)benzoic acid
CID 170993673
4-[2-methoxy-2-[1-methoxy-2-(2-propan-2-yloxy-4-pyridinyl)ethoxy]ethyl]-2-propan-2-yloxypyridine
CID 69013905
2-chloro-4-(1,3-oxazol-2-yl)phenol
CID 137195866
2-(4-butoxyphenyl)-1,3-oxazole
CID 69161830

Frequently Asked Questions

What is the IUPAC name of 2-(2-propan-2-yloxy-4-pyridinyl)-1,3-oxazole?
The IUPAC name of 2-(2-propan-2-yloxy-4-pyridinyl)-1,3-oxazole (CID 123773885) is 2-(2-propan-2-yloxy-4-pyridinyl)-1,3-oxazole.
What is the SMILES notation for 2-(2-propan-2-yloxy-4-pyridinyl)-1,3-oxazole?
The canonical SMILES for 2-(2-propan-2-yloxy-4-pyridinyl)-1,3-oxazole is CC(C)Oc1cc(-c2ncco2)ccn1.
What is the InChIKey of 2-(2-propan-2-yloxy-4-pyridinyl)-1,3-oxazole?
The InChIKey is NZWLKQQQZREUIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2/c1-8(2)15-10-7-9(3-4-12-10)11-13-5-6-14-11/h3-8H,1-2H3.
What are the key properties of 2-(2-propan-2-yloxy-4-pyridinyl)-1,3-oxazole?
2-(2-propan-2-yloxy-4-pyridinyl)-1,3-oxazole has a molecular weight of 204.23 g/mol, XLogP of 2.52, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-propan-2-yloxy-4-pyridinyl)-1,3-oxazole is sourced from PubChem (CID 123773885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).