2-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl-methylamino]-N,N-dimethylacetamide

C11H19N3O2 — CID 47010607

IUPAC2-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl-methylamino]-N,N-dimethylacetamide
SMILESCc1noc(C)c1CN(C)CC(=O)N(C)C
InChIInChI=1S/C11H19N3O2/c1-8-10(9(2)16-12-8)6-14(5)7-11(15)13(3)4/h6-7H2,1-5H3
InChIKeyYIZPBXNYKBEICW-UHFFFAOYSA-N
MW225.29 g/mol
LogP0.81
Rot. Bonds4

About 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl-methylamino]-N,N-dimethylacetamide

2-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl-methylamino]-N,N-dimethylacetamide (PubChem CID 47010607) has the molecular formula C11H19N3O2 and a molecular weight of 225.29 g/mol. Its IUPAC name is 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl-methylamino]-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl-methylamino]-N,N-dimethylacetamide
PubChem CID47010607
Molecular FormulaC11H19N3O2
Molecular Weight225.29 g/mol
Exact Mass225.15
IUPAC Name2-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl-methylamino]-N,N-dimethylacetamide
SMILESCc1noc(C)c1CN(C)CC(=O)N(C)C
InChIInChI=1S/C11H19N3O2/c1-8-10(9(2)16-12-8)6-14(5)7-11(15)13(3)4/h6-7H2,1-5H3
InChIKeyYIZPBXNYKBEICW-UHFFFAOYSA-N
XLogP0.81
TPSA49.58 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 50.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl-methylamino]-N,N-dimethylacetamide?
The IUPAC name of 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl-methylamino]-N,N-dimethylacetamide (CID 47010607) is 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl-methylamino]-N,N-dimethylacetamide.
What is the SMILES notation for 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl-methylamino]-N,N-dimethylacetamide?
The canonical SMILES for 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl-methylamino]-N,N-dimethylacetamide is Cc1noc(C)c1CN(C)CC(=O)N(C)C.
What is the InChIKey of 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl-methylamino]-N,N-dimethylacetamide?
The InChIKey is YIZPBXNYKBEICW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2/c1-8-10(9(2)16-12-8)6-14(5)7-11(15)13(3)4/h6-7H2,1-5H3.
What are the key properties of 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl-methylamino]-N,N-dimethylacetamide?
2-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl-methylamino]-N,N-dimethylacetamide has a molecular weight of 225.29 g/mol, XLogP of 0.81, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl-methylamino]-N,N-dimethylacetamide is sourced from PubChem (CID 47010607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).