2-acetamido-N-prop-2-enylideneacetamide

C7H10N2O2 — CID 165430636

IUPAC2-acetamido-N-prop-2-enylideneacetamide
SMILESC=C/C=N/C(=O)CNC(C)=O
InChIInChI=1S/C7H10N2O2/c1-3-4-8-7(11)5-9-6(2)10/h3-4H,1,5H2,2H3,(H,9,10)/b8-4+
InChIKeyDSHANFFIVIVYBG-XBXARRHUSA-N
MW154.17 g/mol
LogP-0.09
Rot. Bonds3

About 2-acetamido-N-prop-2-enylideneacetamide

2-acetamido-N-prop-2-enylideneacetamide (PubChem CID 165430636) has the molecular formula C7H10N2O2 and a molecular weight of 154.17 g/mol. Its IUPAC name is 2-acetamido-N-prop-2-enylideneacetamide.

Molecular Properties

Compound Name2-acetamido-N-prop-2-enylideneacetamide
PubChem CID165430636
Molecular FormulaC7H10N2O2
Molecular Weight154.17 g/mol
Exact Mass154.07
IUPAC Name2-acetamido-N-prop-2-enylideneacetamide
SMILESC=C/C=N/C(=O)CNC(C)=O
InChIInChI=1S/C7H10N2O2/c1-3-4-8-7(11)5-9-6(2)10/h3-4H,1,5H2,2H3,(H,9,10)/b8-4+
InChIKeyDSHANFFIVIVYBG-XBXARRHUSA-N
XLogP-0.09
TPSA58.53 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 5-0.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-acetamido-N-prop-2-enylideneacetamide?
The IUPAC name of 2-acetamido-N-prop-2-enylideneacetamide (CID 165430636) is 2-acetamido-N-prop-2-enylideneacetamide.
What is the SMILES notation for 2-acetamido-N-prop-2-enylideneacetamide?
The canonical SMILES for 2-acetamido-N-prop-2-enylideneacetamide is C=C/C=N/C(=O)CNC(C)=O.
What is the InChIKey of 2-acetamido-N-prop-2-enylideneacetamide?
The InChIKey is DSHANFFIVIVYBG-XBXARRHUSA-N. The full InChI is InChI=1S/C7H10N2O2/c1-3-4-8-7(11)5-9-6(2)10/h3-4H,1,5H2,2H3,(H,9,10)/b8-4+.
What are the key properties of 2-acetamido-N-prop-2-enylideneacetamide?
2-acetamido-N-prop-2-enylideneacetamide has a molecular weight of 154.17 g/mol, XLogP of -0.09, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-N-prop-2-enylideneacetamide is sourced from PubChem (CID 165430636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).