2-methoxy-N-methylbut-2-enamide

C6H11NO2 — CID 153279971

IUPAC2-methoxy-N-methylbut-2-enamide
SMILESCC=C(OC)C(=O)NC
InChIInChI=1S/C6H11NO2/c1-4-5(9-3)6(8)7-2/h4H,1-3H3,(H,7,8)
InChIKeyDWCLTQBRZAIXGN-UHFFFAOYSA-N
MW129.16 g/mol
LogP0.28
Rot. Bonds2

About 2-methoxy-N-methylbut-2-enamide

2-methoxy-N-methylbut-2-enamide (PubChem CID 153279971) has the molecular formula C6H11NO2 and a molecular weight of 129.16 g/mol. Its IUPAC name is 2-methoxy-N-methylbut-2-enamide.

Molecular Properties

Compound Name2-methoxy-N-methylbut-2-enamide
PubChem CID153279971
Molecular FormulaC6H11NO2
Molecular Weight129.16 g/mol
Exact Mass129.08
IUPAC Name2-methoxy-N-methylbut-2-enamide
SMILESCC=C(OC)C(=O)NC
InChIInChI=1S/C6H11NO2/c1-4-5(9-3)6(8)7-2/h4H,1-3H3,(H,7,8)
InChIKeyDWCLTQBRZAIXGN-UHFFFAOYSA-N
XLogP0.28
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.16
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

2-Oxo-3-methoxy-3-pyrroline
CID 129696258
3,4-Dimethoxy-3-pyrrolin-2-one
CID 55287005
2-ethoxy-N-methylprop-2-enamide
CID 53979544
(Z)-2-methoxybut-2-enamide
CID 55291471
2-methoxy-N-methylprop-2-enamide
CID 59553923
N-methyloxirene-2-carboxamide
CID 69294241
2-Methoxybut-2-enamide
CID 76224786
N-methyl-2-propoxybut-2-enamide
CID 88187241
N-methyl-2,3-dihydrofuran-5-carboxamide
CID 89344938
(Z)-2-hydroxy-N-methylbut-2-enamide
CID 139769569
2-ethenoxy-N-methylprop-2-enamide
CID 142147604
N-methyl-4H-pyran-2-carboxamide
CID 142682969

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-methylbut-2-enamide?
The IUPAC name of 2-methoxy-N-methylbut-2-enamide (CID 153279971) is 2-methoxy-N-methylbut-2-enamide.
What is the SMILES notation for 2-methoxy-N-methylbut-2-enamide?
The canonical SMILES for 2-methoxy-N-methylbut-2-enamide is CC=C(OC)C(=O)NC.
What is the InChIKey of 2-methoxy-N-methylbut-2-enamide?
The InChIKey is DWCLTQBRZAIXGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO2/c1-4-5(9-3)6(8)7-2/h4H,1-3H3,(H,7,8).
What are the key properties of 2-methoxy-N-methylbut-2-enamide?
2-methoxy-N-methylbut-2-enamide has a molecular weight of 129.16 g/mol, XLogP of 0.28, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-methylbut-2-enamide is sourced from PubChem (CID 153279971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).