2,2-dimethyl-N-(5-methyl-1,2-oxazol-4-yl)propanamide

C9H14N2O2 — CID 13483366

IUPAC2,2-dimethyl-N-(5-methyl-1,2-oxazol-4-yl)propanamide
SMILESCc1oncc1NC(=O)C(C)(C)C
InChIInChI=1S/C9H14N2O2/c1-6-7(5-10-13-6)11-8(12)9(2,3)4/h5H,1-4H3,(H,11,12)
InChIKeyBOFWPIAKDVOCLI-UHFFFAOYSA-N
MW182.22 g/mol
LogP1.97
Rot. Bonds1

About 2,2-dimethyl-N-(5-methyl-1,2-oxazol-4-yl)propanamide

2,2-dimethyl-N-(5-methyl-1,2-oxazol-4-yl)propanamide (PubChem CID 13483366) has the molecular formula C9H14N2O2 and a molecular weight of 182.22 g/mol. Its IUPAC name is 2,2-dimethyl-N-(5-methyl-1,2-oxazol-4-yl)propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-(5-methyl-1,2-oxazol-4-yl)propanamide
PubChem CID13483366
Molecular FormulaC9H14N2O2
Molecular Weight182.22 g/mol
Exact Mass182.11
IUPAC Name2,2-dimethyl-N-(5-methyl-1,2-oxazol-4-yl)propanamide
SMILESCc1oncc1NC(=O)C(C)(C)C
InChIInChI=1S/C9H14N2O2/c1-6-7(5-10-13-6)11-8(12)9(2,3)4/h5H,1-4H3,(H,11,12)
InChIKeyBOFWPIAKDVOCLI-UHFFFAOYSA-N
XLogP1.97
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.22
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-(5-methyl-1,2-oxazol-4-yl)propanamide?
The IUPAC name of 2,2-dimethyl-N-(5-methyl-1,2-oxazol-4-yl)propanamide (CID 13483366) is 2,2-dimethyl-N-(5-methyl-1,2-oxazol-4-yl)propanamide.
What is the SMILES notation for 2,2-dimethyl-N-(5-methyl-1,2-oxazol-4-yl)propanamide?
The canonical SMILES for 2,2-dimethyl-N-(5-methyl-1,2-oxazol-4-yl)propanamide is Cc1oncc1NC(=O)C(C)(C)C.
What is the InChIKey of 2,2-dimethyl-N-(5-methyl-1,2-oxazol-4-yl)propanamide?
The InChIKey is BOFWPIAKDVOCLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O2/c1-6-7(5-10-13-6)11-8(12)9(2,3)4/h5H,1-4H3,(H,11,12).
What are the key properties of 2,2-dimethyl-N-(5-methyl-1,2-oxazol-4-yl)propanamide?
2,2-dimethyl-N-(5-methyl-1,2-oxazol-4-yl)propanamide has a molecular weight of 182.22 g/mol, XLogP of 1.97, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-(5-methyl-1,2-oxazol-4-yl)propanamide is sourced from PubChem (CID 13483366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).