N,2-dimethylprop-2-enamide;ethane

C7H15NO — CID 142291054

IUPACN,2-dimethylprop-2-enamide;ethane
SMILESC=C(C)C(=O)NC.CC
InChIInChI=1S/C5H9NO.C2H6/c1-4(2)5(7)6-3;1-2/h1H2,2-3H3,(H,6,7);1-2H3
InChIKeyIVCJVSIZERMTRJ-UHFFFAOYSA-N
MW129.20 g/mol
LogP1.33
Rot. Bonds1

About N,2-dimethylprop-2-enamide;ethane

N,2-dimethylprop-2-enamide;ethane (PubChem CID 142291054) has the molecular formula C7H15NO and a molecular weight of 129.20 g/mol. Its IUPAC name is N,2-dimethylprop-2-enamide;ethane.

Molecular Properties

Compound NameN,2-dimethylprop-2-enamide;ethane
PubChem CID142291054
Molecular FormulaC7H15NO
Molecular Weight129.20 g/mol
Exact Mass129.12
IUPAC NameN,2-dimethylprop-2-enamide;ethane
SMILESC=C(C)C(=O)NC.CC
InChIInChI=1S/C5H9NO.C2H6/c1-4(2)5(7)6-3;1-2/h1H2,2-3H3,(H,6,7);1-2H3
InChIKeyIVCJVSIZERMTRJ-UHFFFAOYSA-N
XLogP1.33
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.20
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

N,N'-di((113C)methyl)oxamide
CID 169438737
ethane;2-methyl-N-[2-(methylamino)ethyl]prop-2-enamide
CID 145071357
2-methyl-N-(2-methylprop-2-enoylcarbamoyl)prop-2-enamide
CID 14817903
ethane;(2E)-N-methyl-2-prop-1-en-2-ylpenta-2,4-dienamide;rutherfordium
CID 178150779
2-methyl-N-[1-(methylamino)-1-oxopropan-2-yl]prop-2-enamide
CID 23064653
N-methylmethanamine;bis(2-methylprop-2-enoic acid)
CID 175091080
N-(1-hydroxyethenyl)-2-methylprop-2-enamide
CID 174577557
ethane;methane;N-methylacetamide
CID 159401147
formaldehyde;N-methylacetamide
CID 159490973
ethane;bis(2-methylprop-2-enoic acid)
CID 87619293
N-ethanethioyl-2-methylprop-2-enamide
CID 89169552
CID 159556955
CID 159556955

Frequently Asked Questions

What is the IUPAC name of N,2-dimethylprop-2-enamide;ethane?
The IUPAC name of N,2-dimethylprop-2-enamide;ethane (CID 142291054) is N,2-dimethylprop-2-enamide;ethane.
What is the SMILES notation for N,2-dimethylprop-2-enamide;ethane?
The canonical SMILES for N,2-dimethylprop-2-enamide;ethane is C=C(C)C(=O)NC.CC.
What is the InChIKey of N,2-dimethylprop-2-enamide;ethane?
The InChIKey is IVCJVSIZERMTRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9NO.C2H6/c1-4(2)5(7)6-3;1-2/h1H2,2-3H3,(H,6,7);1-2H3.
What are the key properties of N,2-dimethylprop-2-enamide;ethane?
N,2-dimethylprop-2-enamide;ethane has a molecular weight of 129.20 g/mol, XLogP of 1.33, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethylprop-2-enamide;ethane is sourced from PubChem (CID 142291054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).