2-[[2-(dimethylamino)-2-oxoethyl]amino]-N-propan-2-ylacetamide

C9H19N3O2 — CID 43214984

IUPAC2-[[2-(dimethylamino)-2-oxoethyl]amino]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CNCC(=O)N(C)C
InChIInChI=1S/C9H19N3O2/c1-7(2)11-8(13)5-10-6-9(14)12(3)4/h7,10H,5-6H2,1-4H3,(H,11,13)
InChIKeyJWCFPVUWUQGKDP-UHFFFAOYSA-N
MW201.27 g/mol
LogP-0.81
Rot. Bonds5

About 2-[[2-(dimethylamino)-2-oxoethyl]amino]-N-propan-2-ylacetamide

2-[[2-(dimethylamino)-2-oxoethyl]amino]-N-propan-2-ylacetamide (PubChem CID 43214984) has the molecular formula C9H19N3O2 and a molecular weight of 201.27 g/mol. Its IUPAC name is 2-[[2-(dimethylamino)-2-oxoethyl]amino]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[[2-(dimethylamino)-2-oxoethyl]amino]-N-propan-2-ylacetamide
PubChem CID43214984
Molecular FormulaC9H19N3O2
Molecular Weight201.27 g/mol
Exact Mass201.15
IUPAC Name2-[[2-(dimethylamino)-2-oxoethyl]amino]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CNCC(=O)N(C)C
InChIInChI=1S/C9H19N3O2/c1-7(2)11-8(13)5-10-6-9(14)12(3)4/h7,10H,5-6H2,1-4H3,(H,11,13)
InChIKeyJWCFPVUWUQGKDP-UHFFFAOYSA-N
XLogP-0.81
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 5-0.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[[2-(dimethylamino)-2-oxoethyl]amino]-N-propan-2-ylacetamide?
The IUPAC name of 2-[[2-(dimethylamino)-2-oxoethyl]amino]-N-propan-2-ylacetamide (CID 43214984) is 2-[[2-(dimethylamino)-2-oxoethyl]amino]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[[2-(dimethylamino)-2-oxoethyl]amino]-N-propan-2-ylacetamide?
The canonical SMILES for 2-[[2-(dimethylamino)-2-oxoethyl]amino]-N-propan-2-ylacetamide is CC(C)NC(=O)CNCC(=O)N(C)C.
What is the InChIKey of 2-[[2-(dimethylamino)-2-oxoethyl]amino]-N-propan-2-ylacetamide?
The InChIKey is JWCFPVUWUQGKDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O2/c1-7(2)11-8(13)5-10-6-9(14)12(3)4/h7,10H,5-6H2,1-4H3,(H,11,13).
What are the key properties of 2-[[2-(dimethylamino)-2-oxoethyl]amino]-N-propan-2-ylacetamide?
2-[[2-(dimethylamino)-2-oxoethyl]amino]-N-propan-2-ylacetamide has a molecular weight of 201.27 g/mol, XLogP of -0.81, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(dimethylamino)-2-oxoethyl]amino]-N-propan-2-ylacetamide is sourced from PubChem (CID 43214984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).