2-(methylamino)-N-prop-2-enylacetamide

C6H12N2O — CID 24706620

IUPAC2-(methylamino)-N-prop-2-enylacetamide
SMILESC=CCNC(=O)CNC
InChIInChI=1S/C6H12N2O/c1-3-4-8-6(9)5-7-2/h3,7H,1,4-5H2,2H3,(H,8,9)
InChIKeyJDPRYDGHIPLZMU-UHFFFAOYSA-N
MW128.17 g/mol
LogP-0.49
Rot. Bonds4

About 2-(methylamino)-N-prop-2-enylacetamide

2-(methylamino)-N-prop-2-enylacetamide (PubChem CID 24706620) has the molecular formula C6H12N2O and a molecular weight of 128.17 g/mol. Its IUPAC name is 2-(methylamino)-N-prop-2-enylacetamide.

Molecular Properties

Compound Name2-(methylamino)-N-prop-2-enylacetamide
PubChem CID24706620
Molecular FormulaC6H12N2O
Molecular Weight128.17 g/mol
Exact Mass128.09
IUPAC Name2-(methylamino)-N-prop-2-enylacetamide
SMILESC=CCNC(=O)CNC
InChIInChI=1S/C6H12N2O/c1-3-4-8-6(9)5-7-2/h3,7H,1,4-5H2,2H3,(H,8,9)
InChIKeyJDPRYDGHIPLZMU-UHFFFAOYSA-N
XLogP-0.49
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.17
LogP ≤ 5-0.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-prop-2-enylacetamide?
The IUPAC name of 2-(methylamino)-N-prop-2-enylacetamide (CID 24706620) is 2-(methylamino)-N-prop-2-enylacetamide.
What is the SMILES notation for 2-(methylamino)-N-prop-2-enylacetamide?
The canonical SMILES for 2-(methylamino)-N-prop-2-enylacetamide is C=CCNC(=O)CNC.
What is the InChIKey of 2-(methylamino)-N-prop-2-enylacetamide?
The InChIKey is JDPRYDGHIPLZMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O/c1-3-4-8-6(9)5-7-2/h3,7H,1,4-5H2,2H3,(H,8,9).
What are the key properties of 2-(methylamino)-N-prop-2-enylacetamide?
2-(methylamino)-N-prop-2-enylacetamide has a molecular weight of 128.17 g/mol, XLogP of -0.49, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-prop-2-enylacetamide is sourced from PubChem (CID 24706620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).