N-(4,5-dimethyl-1,3-oxazol-2-yl)-N-methylacetamide

C8H12N2O2 — CID 12556908

IUPACN-(4,5-dimethyl-1,3-oxazol-2-yl)-N-methylacetamide
SMILESCC(=O)N(C)c1nc(C)c(C)o1
InChIInChI=1S/C8H12N2O2/c1-5-6(2)12-8(9-5)10(4)7(3)11/h1-4H3
InChIKeyWQGUCTZWZZAMQP-UHFFFAOYSA-N
MW168.20 g/mol
LogP1.27
Rot. Bonds1

About N-(4,5-dimethyl-1,3-oxazol-2-yl)-N-methylacetamide

N-(4,5-dimethyl-1,3-oxazol-2-yl)-N-methylacetamide (PubChem CID 12556908) has the molecular formula C8H12N2O2 and a molecular weight of 168.20 g/mol. Its IUPAC name is N-(4,5-dimethyl-1,3-oxazol-2-yl)-N-methylacetamide.

Molecular Properties

Compound NameN-(4,5-dimethyl-1,3-oxazol-2-yl)-N-methylacetamide
PubChem CID12556908
Molecular FormulaC8H12N2O2
Molecular Weight168.20 g/mol
Exact Mass168.09
IUPAC NameN-(4,5-dimethyl-1,3-oxazol-2-yl)-N-methylacetamide
SMILESCC(=O)N(C)c1nc(C)c(C)o1
InChIInChI=1S/C8H12N2O2/c1-5-6(2)12-8(9-5)10(4)7(3)11/h1-4H3
InChIKeyWQGUCTZWZZAMQP-UHFFFAOYSA-N
XLogP1.27
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.20
LogP ≤ 51.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4,5-dimethyl-1,3-oxazol-2-yl)-N-methylacetamide?
The IUPAC name of N-(4,5-dimethyl-1,3-oxazol-2-yl)-N-methylacetamide (CID 12556908) is N-(4,5-dimethyl-1,3-oxazol-2-yl)-N-methylacetamide.
What is the SMILES notation for N-(4,5-dimethyl-1,3-oxazol-2-yl)-N-methylacetamide?
The canonical SMILES for N-(4,5-dimethyl-1,3-oxazol-2-yl)-N-methylacetamide is CC(=O)N(C)c1nc(C)c(C)o1.
What is the InChIKey of N-(4,5-dimethyl-1,3-oxazol-2-yl)-N-methylacetamide?
The InChIKey is WQGUCTZWZZAMQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O2/c1-5-6(2)12-8(9-5)10(4)7(3)11/h1-4H3.
What are the key properties of N-(4,5-dimethyl-1,3-oxazol-2-yl)-N-methylacetamide?
N-(4,5-dimethyl-1,3-oxazol-2-yl)-N-methylacetamide has a molecular weight of 168.20 g/mol, XLogP of 1.27, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5-dimethyl-1,3-oxazol-2-yl)-N-methylacetamide is sourced from PubChem (CID 12556908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).