5-(2-ethyl-6-methyl-3-pyridinyl)-3-methyl-4-propan-2-yl-1,2-oxazole

C15H20N2O — CID 90757082

IUPAC5-(2-ethyl-6-methyl-3-pyridinyl)-3-methyl-4-propan-2-yl-1,2-oxazole
SMILESCCc1nc(C)ccc1-c1onc(C)c1C(C)C
InChIInChI=1S/C15H20N2O/c1-6-13-12(8-7-10(4)16-13)15-14(9(2)3)11(5)17-18-15/h7-9H,6H2,1-5H3
InChIKeyJWPITACFCQDAJG-UHFFFAOYSA-N
MW244.34 g/mol
LogP4.04
Rot. Bonds3

About 5-(2-ethyl-6-methyl-3-pyridinyl)-3-methyl-4-propan-2-yl-1,2-oxazole

5-(2-ethyl-6-methyl-3-pyridinyl)-3-methyl-4-propan-2-yl-1,2-oxazole (PubChem CID 90757082) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 5-(2-ethyl-6-methyl-3-pyridinyl)-3-methyl-4-propan-2-yl-1,2-oxazole.

Molecular Properties

Compound Name5-(2-ethyl-6-methyl-3-pyridinyl)-3-methyl-4-propan-2-yl-1,2-oxazole
PubChem CID90757082
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name5-(2-ethyl-6-methyl-3-pyridinyl)-3-methyl-4-propan-2-yl-1,2-oxazole
SMILESCCc1nc(C)ccc1-c1onc(C)c1C(C)C
InChIInChI=1S/C15H20N2O/c1-6-13-12(8-7-10(4)16-13)15-14(9(2)3)11(5)17-18-15/h7-9H,6H2,1-5H3
InChIKeyJWPITACFCQDAJG-UHFFFAOYSA-N
XLogP4.04
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(2-ethyl-6-methyl-3-pyridinyl)-3-methyl-4-propan-2-yl-1,2-oxazole?
The IUPAC name of 5-(2-ethyl-6-methyl-3-pyridinyl)-3-methyl-4-propan-2-yl-1,2-oxazole (CID 90757082) is 5-(2-ethyl-6-methyl-3-pyridinyl)-3-methyl-4-propan-2-yl-1,2-oxazole.
What is the SMILES notation for 5-(2-ethyl-6-methyl-3-pyridinyl)-3-methyl-4-propan-2-yl-1,2-oxazole?
The canonical SMILES for 5-(2-ethyl-6-methyl-3-pyridinyl)-3-methyl-4-propan-2-yl-1,2-oxazole is CCc1nc(C)ccc1-c1onc(C)c1C(C)C.
What is the InChIKey of 5-(2-ethyl-6-methyl-3-pyridinyl)-3-methyl-4-propan-2-yl-1,2-oxazole?
The InChIKey is JWPITACFCQDAJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-6-13-12(8-7-10(4)16-13)15-14(9(2)3)11(5)17-18-15/h7-9H,6H2,1-5H3.
What are the key properties of 5-(2-ethyl-6-methyl-3-pyridinyl)-3-methyl-4-propan-2-yl-1,2-oxazole?
5-(2-ethyl-6-methyl-3-pyridinyl)-3-methyl-4-propan-2-yl-1,2-oxazole has a molecular weight of 244.34 g/mol, XLogP of 4.04, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-ethyl-6-methyl-3-pyridinyl)-3-methyl-4-propan-2-yl-1,2-oxazole is sourced from PubChem (CID 90757082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).