2-(dimethylcarbamoylamino)-N-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]acetamide

C16H20N4O3 — CID 56911061

IUPAC2-(dimethylcarbamoylamino)-N-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]acetamide
SMILESCN(C)C(=O)NCC(=O)N(C)Cc1cc(-c2ccccc2)no1
InChIInChI=1S/C16H20N4O3/c1-19(2)16(22)17-10-15(21)20(3)11-13-9-14(18-23-13)12-7-5-4-6-8-12/h4-9H,10-11H2,1-3H3,(H,17,22)
InChIKeyQXOTXUOBQAEAIC-UHFFFAOYSA-N
MW316.36 g/mol
LogP1.57
Rot. Bonds5

About 2-(dimethylcarbamoylamino)-N-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]acetamide

2-(dimethylcarbamoylamino)-N-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]acetamide (PubChem CID 56911061) has the molecular formula C16H20N4O3 and a molecular weight of 316.36 g/mol. Its IUPAC name is 2-(dimethylcarbamoylamino)-N-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]acetamide.

Molecular Properties

Compound Name2-(dimethylcarbamoylamino)-N-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]acetamide
PubChem CID56911061
Molecular FormulaC16H20N4O3
Molecular Weight316.36 g/mol
Exact Mass316.15
IUPAC Name2-(dimethylcarbamoylamino)-N-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]acetamide
SMILESCN(C)C(=O)NCC(=O)N(C)Cc1cc(-c2ccccc2)no1
InChIInChI=1S/C16H20N4O3/c1-19(2)16(22)17-10-15(21)20(3)11-13-9-14(18-23-13)12-7-5-4-6-8-12/h4-9H,10-11H2,1-3H3,(H,17,22)
InChIKeyQXOTXUOBQAEAIC-UHFFFAOYSA-N
XLogP1.57
TPSA78.68 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.36
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(dimethylcarbamoylamino)-N-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylcarbamoylamino)-N-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]acetamide?
The IUPAC name of 2-(dimethylcarbamoylamino)-N-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]acetamide (CID 56911061) is 2-(dimethylcarbamoylamino)-N-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]acetamide.
What is the SMILES notation for 2-(dimethylcarbamoylamino)-N-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]acetamide?
The canonical SMILES for 2-(dimethylcarbamoylamino)-N-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]acetamide is CN(C)C(=O)NCC(=O)N(C)Cc1cc(-c2ccccc2)no1.
What is the InChIKey of 2-(dimethylcarbamoylamino)-N-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]acetamide?
The InChIKey is QXOTXUOBQAEAIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O3/c1-19(2)16(22)17-10-15(21)20(3)11-13-9-14(18-23-13)12-7-5-4-6-8-12/h4-9H,10-11H2,1-3H3,(H,17,22).
What are the key properties of 2-(dimethylcarbamoylamino)-N-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]acetamide?
2-(dimethylcarbamoylamino)-N-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]acetamide has a molecular weight of 316.36 g/mol, XLogP of 1.57, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylcarbamoylamino)-N-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]acetamide is sourced from PubChem (CID 56911061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).