2-[[2-(dimethylamino)-2-oxoethyl]amino]-N-methylacetamide

C7H15N3O2 — CID 43214721

IUPAC2-[[2-(dimethylamino)-2-oxoethyl]amino]-N-methylacetamide
SMILESCNC(=O)CNCC(=O)N(C)C
InChIInChI=1S/C7H15N3O2/c1-8-6(11)4-9-5-7(12)10(2)3/h9H,4-5H2,1-3H3,(H,8,11)
InChIKeyMUKHIDAGJQTFQW-UHFFFAOYSA-N
MW173.22 g/mol
LogP-1.59
Rot. Bonds4

About 2-[[2-(dimethylamino)-2-oxoethyl]amino]-N-methylacetamide

2-[[2-(dimethylamino)-2-oxoethyl]amino]-N-methylacetamide (PubChem CID 43214721) has the molecular formula C7H15N3O2 and a molecular weight of 173.22 g/mol. Its IUPAC name is 2-[[2-(dimethylamino)-2-oxoethyl]amino]-N-methylacetamide.

Molecular Properties

Compound Name2-[[2-(dimethylamino)-2-oxoethyl]amino]-N-methylacetamide
PubChem CID43214721
Molecular FormulaC7H15N3O2
Molecular Weight173.22 g/mol
Exact Mass173.12
IUPAC Name2-[[2-(dimethylamino)-2-oxoethyl]amino]-N-methylacetamide
SMILESCNC(=O)CNCC(=O)N(C)C
InChIInChI=1S/C7H15N3O2/c1-8-6(11)4-9-5-7(12)10(2)3/h9H,4-5H2,1-3H3,(H,8,11)
InChIKeyMUKHIDAGJQTFQW-UHFFFAOYSA-N
XLogP-1.59
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.22
LogP ≤ 5-1.59
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-methylacetamide?
The IUPAC name of 2-[[2-(dimethylamino)-2-oxoethyl]amino]-N-methylacetamide (CID 43214721) is 2-[[2-(dimethylamino)-2-oxoethyl]amino]-N-methylacetamide.
What is the SMILES notation for 2-[[2-(dimethylamino)-2-oxoethyl]amino]-N-methylacetamide?
The canonical SMILES for 2-[[2-(dimethylamino)-2-oxoethyl]amino]-N-methylacetamide is CNC(=O)CNCC(=O)N(C)C.
What is the InChIKey of 2-[[2-(dimethylamino)-2-oxoethyl]amino]-N-methylacetamide?
The InChIKey is MUKHIDAGJQTFQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N3O2/c1-8-6(11)4-9-5-7(12)10(2)3/h9H,4-5H2,1-3H3,(H,8,11).
What are the key properties of 2-[[2-(dimethylamino)-2-oxoethyl]amino]-N-methylacetamide?
2-[[2-(dimethylamino)-2-oxoethyl]amino]-N-methylacetamide has a molecular weight of 173.22 g/mol, XLogP of -1.59, 4 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-methylacetamide is sourced from PubChem (CID 43214721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).