3-methyl-5-(5-propan-2-yl-2-pyridinyl)-1,2-oxazole

C12H14N2O — CID 176864957

IUPAC3-methyl-5-(5-propan-2-yl-2-pyridinyl)-1,2-oxazole
SMILESCc1cc(-c2ccc(C(C)C)cn2)on1
InChIInChI=1S/C12H14N2O/c1-8(2)10-4-5-11(13-7-10)12-6-9(3)14-15-12/h4-8H,1-3H3
InChIKeyHSEVJWKFBPAHSA-UHFFFAOYSA-N
MW202.26 g/mol
LogP3.17
Rot. Bonds2

About 3-methyl-5-(5-propan-2-yl-2-pyridinyl)-1,2-oxazole

3-methyl-5-(5-propan-2-yl-2-pyridinyl)-1,2-oxazole (PubChem CID 176864957) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is 3-methyl-5-(5-propan-2-yl-2-pyridinyl)-1,2-oxazole.

Molecular Properties

Compound Name3-methyl-5-(5-propan-2-yl-2-pyridinyl)-1,2-oxazole
PubChem CID176864957
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC Name3-methyl-5-(5-propan-2-yl-2-pyridinyl)-1,2-oxazole
SMILESCc1cc(-c2ccc(C(C)C)cn2)on1
InChIInChI=1S/C12H14N2O/c1-8(2)10-4-5-11(13-7-10)12-6-9(3)14-15-12/h4-8H,1-3H3
InChIKeyHSEVJWKFBPAHSA-UHFFFAOYSA-N
XLogP3.17
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 53.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-(5-bromo-2-pyridinyl)-3-methyl-1,2-oxazole
CID 169499011
N,N-dimethyl-5-(3-methyl-1,2-oxazol-5-yl)-4-propan-2-ylpyrimidin-2-amine
CID 73439781
2-(3-methylpyrazol-1-yl)-5-propan-2-ylpyridine
CID 66831246
2-(2-methyltetrazol-5-yl)-5-propan-2-ylpyridine
CID 130333119
4,5-dimethyl-2-(4-propan-2-ylphenyl)pyridine
CID 59538629
6-methylpyrazolo[3,4-e]oxazine
CID 162788939
3-methyl-5-(5-methylfuran-2-yl)-1,2-oxazole
CID 116868998
5-(2-methoxy-3-propan-2-ylphenyl)-3-methyl-1,2-oxazole
CID 166023711
2-phenyl-5-propan-2-ylpyridine;3-propan-2-ylpyridine
CID 177029893
4-[[[5-(3-methyl-1,2-oxazol-5-yl)-4-propan-2-ylpyrimidin-2-yl]amino]methyl]benzonitrile
CID 163507989
2-methoxy-5-(3-methyl-1,2-oxazol-5-yl)-N-(4-propan-2-ylphenyl)benzenesulfonamide
CID 20935095
N-ethyl-N-methyl-5-(3-methyl-1,2-oxazol-5-yl)-4-propan-2-ylpyrimidin-2-amine
CID 167025643

Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-(5-propan-2-yl-2-pyridinyl)-1,2-oxazole?
The IUPAC name of 3-methyl-5-(5-propan-2-yl-2-pyridinyl)-1,2-oxazole (CID 176864957) is 3-methyl-5-(5-propan-2-yl-2-pyridinyl)-1,2-oxazole.
What is the SMILES notation for 3-methyl-5-(5-propan-2-yl-2-pyridinyl)-1,2-oxazole?
The canonical SMILES for 3-methyl-5-(5-propan-2-yl-2-pyridinyl)-1,2-oxazole is Cc1cc(-c2ccc(C(C)C)cn2)on1.
What is the InChIKey of 3-methyl-5-(5-propan-2-yl-2-pyridinyl)-1,2-oxazole?
The InChIKey is HSEVJWKFBPAHSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-8(2)10-4-5-11(13-7-10)12-6-9(3)14-15-12/h4-8H,1-3H3.
What are the key properties of 3-methyl-5-(5-propan-2-yl-2-pyridinyl)-1,2-oxazole?
3-methyl-5-(5-propan-2-yl-2-pyridinyl)-1,2-oxazole has a molecular weight of 202.26 g/mol, XLogP of 3.17, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-(5-propan-2-yl-2-pyridinyl)-1,2-oxazole is sourced from PubChem (CID 176864957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).