N-methyl-N-prop-2-enylacetamide

C6H11NO — CID 14417064

IUPACN-methyl-N-prop-2-enylacetamide
SMILESC=CCN(C)C(C)=O
InChIInChI=1S/C6H11NO/c1-4-5-7(3)6(2)8/h4H,1,5H2,2-3H3
InChIKeyHLNSIFBJBPSASG-UHFFFAOYSA-N
MW113.16 g/mol
LogP0.65
Rot. Bonds2

About N-methyl-N-prop-2-enylacetamide

N-methyl-N-prop-2-enylacetamide (PubChem CID 14417064) has the molecular formula C6H11NO and a molecular weight of 113.16 g/mol. Its IUPAC name is N-methyl-N-prop-2-enylacetamide.

Molecular Properties

Compound NameN-methyl-N-prop-2-enylacetamide
PubChem CID14417064
Molecular FormulaC6H11NO
Molecular Weight113.16 g/mol
Exact Mass113.08
IUPAC NameN-methyl-N-prop-2-enylacetamide
SMILESC=CCN(C)C(C)=O
InChIInChI=1S/C6H11NO/c1-4-5-7(3)6(2)8/h4H,1,5H2,2-3H3
InChIKeyHLNSIFBJBPSASG-UHFFFAOYSA-N
XLogP0.65
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.16
LogP ≤ 50.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 N-methyl-N-prop-2-enylacetamide?
The IUPAC name of N-methyl-N-prop-2-enylacetamide (CID 14417064) is N-methyl-N-prop-2-enylacetamide.
What is the SMILES notation for N-methyl-N-prop-2-enylacetamide?
The canonical SMILES for N-methyl-N-prop-2-enylacetamide is C=CCN(C)C(C)=O.
What is the InChIKey of N-methyl-N-prop-2-enylacetamide?
The InChIKey is HLNSIFBJBPSASG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO/c1-4-5-7(3)6(2)8/h4H,1,5H2,2-3H3.
What are the key properties of N-methyl-N-prop-2-enylacetamide?
N-methyl-N-prop-2-enylacetamide has a molecular weight of 113.16 g/mol, XLogP of 0.65, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-prop-2-enylacetamide is sourced from PubChem (CID 14417064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).