N,2-dimethyl-N-(4-methyl-1,3-oxazol-2-yl)propanamide

C9H14N2O2 — CID 12556872

IUPACN,2-dimethyl-N-(4-methyl-1,3-oxazol-2-yl)propanamide
SMILESCc1coc(N(C)C(=O)C(C)C)n1
InChIInChI=1S/C9H14N2O2/c1-6(2)8(12)11(4)9-10-7(3)5-13-9/h5-6H,1-4H3
InChIKeyICRWBBQXMVAKAK-UHFFFAOYSA-N
MW182.22 g/mol
LogP1.60
Rot. Bonds2

About N,2-dimethyl-N-(4-methyl-1,3-oxazol-2-yl)propanamide

N,2-dimethyl-N-(4-methyl-1,3-oxazol-2-yl)propanamide (PubChem CID 12556872) has the molecular formula C9H14N2O2 and a molecular weight of 182.22 g/mol. Its IUPAC name is N,2-dimethyl-N-(4-methyl-1,3-oxazol-2-yl)propanamide.

Molecular Properties

Compound NameN,2-dimethyl-N-(4-methyl-1,3-oxazol-2-yl)propanamide
PubChem CID12556872
Molecular FormulaC9H14N2O2
Molecular Weight182.22 g/mol
Exact Mass182.11
IUPAC NameN,2-dimethyl-N-(4-methyl-1,3-oxazol-2-yl)propanamide
SMILESCc1coc(N(C)C(=O)C(C)C)n1
InChIInChI=1S/C9H14N2O2/c1-6(2)8(12)11(4)9-10-7(3)5-13-9/h5-6H,1-4H3
InChIKeyICRWBBQXMVAKAK-UHFFFAOYSA-N
XLogP1.60
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.22
LogP ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-(4-methyl-1,3-oxazol-2-yl)propanamide?
The IUPAC name of N,2-dimethyl-N-(4-methyl-1,3-oxazol-2-yl)propanamide (CID 12556872) is N,2-dimethyl-N-(4-methyl-1,3-oxazol-2-yl)propanamide.
What is the SMILES notation for N,2-dimethyl-N-(4-methyl-1,3-oxazol-2-yl)propanamide?
The canonical SMILES for N,2-dimethyl-N-(4-methyl-1,3-oxazol-2-yl)propanamide is Cc1coc(N(C)C(=O)C(C)C)n1.
What is the InChIKey of N,2-dimethyl-N-(4-methyl-1,3-oxazol-2-yl)propanamide?
The InChIKey is ICRWBBQXMVAKAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O2/c1-6(2)8(12)11(4)9-10-7(3)5-13-9/h5-6H,1-4H3.
What are the key properties of N,2-dimethyl-N-(4-methyl-1,3-oxazol-2-yl)propanamide?
N,2-dimethyl-N-(4-methyl-1,3-oxazol-2-yl)propanamide has a molecular weight of 182.22 g/mol, XLogP of 1.60, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-(4-methyl-1,3-oxazol-2-yl)propanamide is sourced from PubChem (CID 12556872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).