N-ethenoxy-2-methylprop-2-enamide

C6H9NO2 — CID 102118163

IUPACN-ethenoxy-2-methylprop-2-enamide
SMILESC=CONC(=O)C(=C)C
InChIInChI=1S/C6H9NO2/c1-4-9-7-6(8)5(2)3/h4H,1-2H2,3H3,(H,7,8)
InChIKeyICRWXRQUOOLJCN-UHFFFAOYSA-N
MW127.14 g/mol
LogP0.75
Rot. Bonds3

About N-ethenoxy-2-methylprop-2-enamide

N-ethenoxy-2-methylprop-2-enamide (PubChem CID 102118163) has the molecular formula C6H9NO2 and a molecular weight of 127.14 g/mol. Its IUPAC name is N-ethenoxy-2-methylprop-2-enamide.

Molecular Properties

Compound NameN-ethenoxy-2-methylprop-2-enamide
PubChem CID102118163
Molecular FormulaC6H9NO2
Molecular Weight127.14 g/mol
Exact Mass127.06
IUPAC NameN-ethenoxy-2-methylprop-2-enamide
SMILESC=CONC(=O)C(=C)C
InChIInChI=1S/C6H9NO2/c1-4-9-7-6(8)5(2)3/h4H,1-2H2,3H3,(H,7,8)
InChIKeyICRWXRQUOOLJCN-UHFFFAOYSA-N
XLogP0.75
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.14
LogP ≤ 50.75
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'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-methyl-N-(prop-2-enoylamino)oxyprop-2-enamide
CID 143303309
N-[(E)-hept-1-enoxy]-2-methylprop-2-enamide
CID 102118177
bis(2-methylprop-2-enoylamino) carbonate
CID 174523368
2-methyl-N-[(E)-undec-1-enoxy]prop-2-enamide
CID 102118207
N-ethenoxy-2-methylpropanamide
CID 174437666
bis(2-methylprop-2-enoylamino) sulfate
CID 174631095
ethyl N-ethenoxycarbamate
CID 57488502
2-methyl-N-undec-10-enoxyprop-2-enamide
CID 102118216
(2-methylprop-2-enoylamino) 2-methoxyiminoacetate
CID 174478351
4-ethenoxy-2-methylhexa-1,4-dien-3-one
CID 123413127
2-methyl-N-[(E)-pent-3-enoxy]prop-2-enamide
CID 102118170
N-(2-buta-1,3-dien-2-yloxyethyl)-2-methylprop-2-enamide
CID 23525810

Frequently Asked Questions

What is the IUPAC name of N-ethenoxy-2-methylprop-2-enamide?
The IUPAC name of N-ethenoxy-2-methylprop-2-enamide (CID 102118163) is N-ethenoxy-2-methylprop-2-enamide.
What is the SMILES notation for N-ethenoxy-2-methylprop-2-enamide?
The canonical SMILES for N-ethenoxy-2-methylprop-2-enamide is C=CONC(=O)C(=C)C.
What is the InChIKey of N-ethenoxy-2-methylprop-2-enamide?
The InChIKey is ICRWXRQUOOLJCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO2/c1-4-9-7-6(8)5(2)3/h4H,1-2H2,3H3,(H,7,8).
What are the key properties of N-ethenoxy-2-methylprop-2-enamide?
N-ethenoxy-2-methylprop-2-enamide has a molecular weight of 127.14 g/mol, XLogP of 0.75, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenoxy-2-methylprop-2-enamide is sourced from PubChem (CID 102118163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).