(Z)-2-ethenoxy-N-methylprop-1-en-1-amine

C6H11NO — CID 143400639

IUPAC(Z)-2-ethenoxy-N-methylprop-1-en-1-amine
SMILESC=CO/C(C)=C\NC
InChIInChI=1S/C6H11NO/c1-4-8-6(2)5-7-3/h4-5,7H,1H2,2-3H3/b6-5-
InChIKeyOKBAALKHWSTFMG-WAYWQWQTSA-N
MW113.16 g/mol
LogP1.23
Rot. Bonds3

About (Z)-2-ethenoxy-N-methylprop-1-en-1-amine

(Z)-2-ethenoxy-N-methylprop-1-en-1-amine (PubChem CID 143400639) has the molecular formula C6H11NO and a molecular weight of 113.16 g/mol. Its IUPAC name is (Z)-2-ethenoxy-N-methylprop-1-en-1-amine.

Molecular Properties

Compound Name(Z)-2-ethenoxy-N-methylprop-1-en-1-amine
PubChem CID143400639
Molecular FormulaC6H11NO
Molecular Weight113.16 g/mol
Exact Mass113.08
IUPAC Name(Z)-2-ethenoxy-N-methylprop-1-en-1-amine
SMILESC=CO/C(C)=C\NC
InChIInChI=1S/C6H11NO/c1-4-8-6(2)5-7-3/h4-5,7H,1H2,2-3H3/b6-5-
InChIKeyOKBAALKHWSTFMG-WAYWQWQTSA-N
XLogP1.23
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.16
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-2-ethenoxy-N-methylprop-1-en-1-amine?
The IUPAC name of (Z)-2-ethenoxy-N-methylprop-1-en-1-amine (CID 143400639) is (Z)-2-ethenoxy-N-methylprop-1-en-1-amine.
What is the SMILES notation for (Z)-2-ethenoxy-N-methylprop-1-en-1-amine?
The canonical SMILES for (Z)-2-ethenoxy-N-methylprop-1-en-1-amine is C=CO/C(C)=C\NC.
What is the InChIKey of (Z)-2-ethenoxy-N-methylprop-1-en-1-amine?
The InChIKey is OKBAALKHWSTFMG-WAYWQWQTSA-N. The full InChI is InChI=1S/C6H11NO/c1-4-8-6(2)5-7-3/h4-5,7H,1H2,2-3H3/b6-5-.
What are the key properties of (Z)-2-ethenoxy-N-methylprop-1-en-1-amine?
(Z)-2-ethenoxy-N-methylprop-1-en-1-amine has a molecular weight of 113.16 g/mol, XLogP of 1.23, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-ethenoxy-N-methylprop-1-en-1-amine is sourced from PubChem (CID 143400639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).