N-[(Z)-2-ethenoxybut-2-enyl]-2-methylprop-2-enamide

C10H15NO2 — CID 143023540

IUPACN-[(Z)-2-ethenoxybut-2-enyl]-2-methylprop-2-enamide
SMILESC=CO/C(=C\C)CNC(=O)C(=C)C
InChIInChI=1S/C10H15NO2/c1-5-9(13-6-2)7-11-10(12)8(3)4/h5-6H,2-3,7H2,1,4H3,(H,11,12)/b9-5-
InChIKeyZCVUMJXQVIYHNY-UITAMQMPSA-N
MW181.23 g/mol
LogP1.74
Rot. Bonds5

About N-[(Z)-2-ethenoxybut-2-enyl]-2-methylprop-2-enamide

N-[(Z)-2-ethenoxybut-2-enyl]-2-methylprop-2-enamide (PubChem CID 143023540) has the molecular formula C10H15NO2 and a molecular weight of 181.23 g/mol. Its IUPAC name is N-[(Z)-2-ethenoxybut-2-enyl]-2-methylprop-2-enamide.

Molecular Properties

Compound NameN-[(Z)-2-ethenoxybut-2-enyl]-2-methylprop-2-enamide
PubChem CID143023540
Molecular FormulaC10H15NO2
Molecular Weight181.23 g/mol
Exact Mass181.11
IUPAC NameN-[(Z)-2-ethenoxybut-2-enyl]-2-methylprop-2-enamide
SMILESC=CO/C(=C\C)CNC(=O)C(=C)C
InChIInChI=1S/C10H15NO2/c1-5-9(13-6-2)7-11-10(12)8(3)4/h5-6H,2-3,7H2,1,4H3,(H,11,12)/b9-5-
InChIKeyZCVUMJXQVIYHNY-UITAMQMPSA-N
XLogP1.74
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.23
LogP ≤ 51.74
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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Frequently Asked Questions

What is the IUPAC name of N-[(Z)-2-ethenoxybut-2-enyl]-2-methylprop-2-enamide?
The IUPAC name of N-[(Z)-2-ethenoxybut-2-enyl]-2-methylprop-2-enamide (CID 143023540) is N-[(Z)-2-ethenoxybut-2-enyl]-2-methylprop-2-enamide.
What is the SMILES notation for N-[(Z)-2-ethenoxybut-2-enyl]-2-methylprop-2-enamide?
The canonical SMILES for N-[(Z)-2-ethenoxybut-2-enyl]-2-methylprop-2-enamide is C=CO/C(=C\C)CNC(=O)C(=C)C.
What is the InChIKey of N-[(Z)-2-ethenoxybut-2-enyl]-2-methylprop-2-enamide?
The InChIKey is ZCVUMJXQVIYHNY-UITAMQMPSA-N. The full InChI is InChI=1S/C10H15NO2/c1-5-9(13-6-2)7-11-10(12)8(3)4/h5-6H,2-3,7H2,1,4H3,(H,11,12)/b9-5-.
What are the key properties of N-[(Z)-2-ethenoxybut-2-enyl]-2-methylprop-2-enamide?
N-[(Z)-2-ethenoxybut-2-enyl]-2-methylprop-2-enamide has a molecular weight of 181.23 g/mol, XLogP of 1.74, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-2-ethenoxybut-2-enyl]-2-methylprop-2-enamide is sourced from PubChem (CID 143023540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).