N-methyl-N-(2-methylprop-2-enyl)acetamide

C7H13NO — CID 115968492

IUPACN-methyl-N-(2-methylprop-2-enyl)acetamide
SMILESC=C(C)CN(C)C(C)=O
InChIInChI=1S/C7H13NO/c1-6(2)5-8(4)7(3)9/h1,5H2,2-4H3
InChIKeyDIVJJROIJJRIDR-UHFFFAOYSA-N
MW127.19 g/mol
LogP1.04
Rot. Bonds2

About N-methyl-N-(2-methylprop-2-enyl)acetamide

N-methyl-N-(2-methylprop-2-enyl)acetamide (PubChem CID 115968492) has the molecular formula C7H13NO and a molecular weight of 127.19 g/mol. Its IUPAC name is N-methyl-N-(2-methylprop-2-enyl)acetamide.

Molecular Properties

Compound NameN-methyl-N-(2-methylprop-2-enyl)acetamide
PubChem CID115968492
Molecular FormulaC7H13NO
Molecular Weight127.19 g/mol
Exact Mass127.10
IUPAC NameN-methyl-N-(2-methylprop-2-enyl)acetamide
SMILESC=C(C)CN(C)C(C)=O
InChIInChI=1S/C7H13NO/c1-6(2)5-8(4)7(3)9/h1,5H2,2-4H3
InChIKeyDIVJJROIJJRIDR-UHFFFAOYSA-N
XLogP1.04
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.19
LogP ≤ 51.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N,N-Diethylmethacrylamide
CID 228225
N-Methyl-N-(prop-2-en-1-yl)acetamide
CID 14417064
N,N-Diallylmethacrylamide
CID 228228
N-(2-methylprop-2-enyl)acetamide
CID 299750
N,N-DI-N-Butylmethacrylamide
CID 9990299
N-butyl-N-isobutenylacetamide
CID 13299350
1,3-dimethyl-2H-pyrrol-5-one
CID 12394645
1-(Aziridin-1-yl)-2-methylprop-2-en-1-one
CID 13685455
N-(2-fluoroethyl)-N,2-dimethylprop-2-enamide
CID 88558388
ethane;2,2,2-trifluoro-N-methyl-N-(2-methylprop-2-enyl)acetamide
CID 143198841
N,N-bis(2-methylprop-2-enyl)acetamide
CID 260942
1-(2-Methylprop-2-enyl)azetidin-2-one
CID 45087251

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-methylprop-2-enyl)acetamide?
The IUPAC name of N-methyl-N-(2-methylprop-2-enyl)acetamide (CID 115968492) is N-methyl-N-(2-methylprop-2-enyl)acetamide.
What is the SMILES notation for N-methyl-N-(2-methylprop-2-enyl)acetamide?
The canonical SMILES for N-methyl-N-(2-methylprop-2-enyl)acetamide is C=C(C)CN(C)C(C)=O.
What is the InChIKey of N-methyl-N-(2-methylprop-2-enyl)acetamide?
The InChIKey is DIVJJROIJJRIDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO/c1-6(2)5-8(4)7(3)9/h1,5H2,2-4H3.
What are the key properties of N-methyl-N-(2-methylprop-2-enyl)acetamide?
N-methyl-N-(2-methylprop-2-enyl)acetamide has a molecular weight of 127.19 g/mol, XLogP of 1.04, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-methylprop-2-enyl)acetamide is sourced from PubChem (CID 115968492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).