5-[5-(2-methylpropyl)-2-pyridinyl]-1,3-oxazole

C12H14N2O — CID 163929053

IUPAC5-[5-(2-methylpropyl)-2-pyridinyl]-1,3-oxazole
SMILESCC(C)Cc1ccc(-c2cnco2)nc1
InChIInChI=1S/C12H14N2O/c1-9(2)5-10-3-4-11(14-6-10)12-7-13-8-15-12/h3-4,6-9H,5H2,1-2H3
InChIKeyRHCMAYJKMCCHMG-UHFFFAOYSA-N
MW202.26 g/mol
LogP2.94
Rot. Bonds3

About 5-[5-(2-methylpropyl)-2-pyridinyl]-1,3-oxazole

5-[5-(2-methylpropyl)-2-pyridinyl]-1,3-oxazole (PubChem CID 163929053) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is 5-[5-(2-methylpropyl)-2-pyridinyl]-1,3-oxazole.

Molecular Properties

Compound Name5-[5-(2-methylpropyl)-2-pyridinyl]-1,3-oxazole
PubChem CID163929053
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC Name5-[5-(2-methylpropyl)-2-pyridinyl]-1,3-oxazole
SMILESCC(C)Cc1ccc(-c2cnco2)nc1
InChIInChI=1S/C12H14N2O/c1-9(2)5-10-3-4-11(14-6-10)12-7-13-8-15-12/h3-4,6-9H,5H2,1-2H3
InChIKeyRHCMAYJKMCCHMG-UHFFFAOYSA-N
XLogP2.94
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

OL-135
CID 10427006
1-[5-(Pyridin-2-yl)-1,3-oxazol-2-yl]-7-[3-(trifluoromethyl)phenyl]heptan-1-one
CID 16735158
Methyl 2-{7-oxo-7-[5-(pyridin-2-yl)-1,3-oxazol-2-yl]heptyl}benzoate
CID 16736221
3-(4-(Phenoxymethyl)phenyl)-1-(5-(pyridin-2-yl)oxazol-2-yl)propan-1-one
CID 16736226
1-Oxo-1-[5-(2-pyridyl)oxazol-2-yl]-7-(3-chlorophenyl)heptane
CID 16736447
3-(4-Phenylphenyl)-1-[5-(pyridin-2-yl)-1,3-oxazol-2-yl]propan-1-one
CID 16737951
3-(1,3-Oxazol-5-yl)aniline
CID 2739289
Pyridine, 4-(5-phenyl-2-oxazolyl)-
CID 156519
6-[2-(7-Phenylheptanoyl)-1,3-oxazol-5-yl]pyridine-2-carboxylic acid
CID 16110715
4-[4-(4-Fluorophenyl)-1,3-oxazol-5-yl]pyridine
CID 16638995
1-Oxo-1-[5-(2-pyridyl)oxazol-2-yl]-3-(4-benzylphenyl)propane
CID 16735162
1-Oxo-1-[5-(2-pyridyl)oxazol-2-yl]-7-(3-hexylphenyl)heptane
CID 16735350

Frequently Asked Questions

What is the IUPAC name of 5-[5-(2-methylpropyl)-2-pyridinyl]-1,3-oxazole?
The IUPAC name of 5-[5-(2-methylpropyl)-2-pyridinyl]-1,3-oxazole (CID 163929053) is 5-[5-(2-methylpropyl)-2-pyridinyl]-1,3-oxazole.
What is the SMILES notation for 5-[5-(2-methylpropyl)-2-pyridinyl]-1,3-oxazole?
The canonical SMILES for 5-[5-(2-methylpropyl)-2-pyridinyl]-1,3-oxazole is CC(C)Cc1ccc(-c2cnco2)nc1.
What is the InChIKey of 5-[5-(2-methylpropyl)-2-pyridinyl]-1,3-oxazole?
The InChIKey is RHCMAYJKMCCHMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-9(2)5-10-3-4-11(14-6-10)12-7-13-8-15-12/h3-4,6-9H,5H2,1-2H3.
What are the key properties of 5-[5-(2-methylpropyl)-2-pyridinyl]-1,3-oxazole?
5-[5-(2-methylpropyl)-2-pyridinyl]-1,3-oxazole has a molecular weight of 202.26 g/mol, XLogP of 2.94, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[5-(2-methylpropyl)-2-pyridinyl]-1,3-oxazole is sourced from PubChem (CID 163929053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).