(Z)-2-(2-methylprop-1-enoxy)ethenamine

C6H11NO — CID 143419013

IUPAC(Z)-2-(2-methylprop-1-enoxy)ethenamine
SMILESCC(C)=CO/C=C\N
InChIInChI=1S/C6H11NO/c1-6(2)5-8-4-3-7/h3-5H,7H2,1-2H3/b4-3-
InChIKeyISDISEVBOKXHQI-ARJAWSKDSA-N
MW113.16 g/mol
LogP1.36
Rot. Bonds2

About (Z)-2-(2-methylprop-1-enoxy)ethenamine

(Z)-2-(2-methylprop-1-enoxy)ethenamine (PubChem CID 143419013) has the molecular formula C6H11NO and a molecular weight of 113.16 g/mol. Its IUPAC name is (Z)-2-(2-methylprop-1-enoxy)ethenamine.

Molecular Properties

Compound Name(Z)-2-(2-methylprop-1-enoxy)ethenamine
PubChem CID143419013
Molecular FormulaC6H11NO
Molecular Weight113.16 g/mol
Exact Mass113.08
IUPAC Name(Z)-2-(2-methylprop-1-enoxy)ethenamine
SMILESCC(C)=CO/C=C\N
InChIInChI=1S/C6H11NO/c1-6(2)5-8-4-3-7/h3-5H,7H2,1-2H3/b4-3-
InChIKeyISDISEVBOKXHQI-ARJAWSKDSA-N
XLogP1.36
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.16
LogP ≤ 51.36
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-(2-methylprop-1-enoxy)ethenamine?
The IUPAC name of (Z)-2-(2-methylprop-1-enoxy)ethenamine (CID 143419013) is (Z)-2-(2-methylprop-1-enoxy)ethenamine.
What is the SMILES notation for (Z)-2-(2-methylprop-1-enoxy)ethenamine?
The canonical SMILES for (Z)-2-(2-methylprop-1-enoxy)ethenamine is CC(C)=CO/C=C\N.
What is the InChIKey of (Z)-2-(2-methylprop-1-enoxy)ethenamine?
The InChIKey is ISDISEVBOKXHQI-ARJAWSKDSA-N. The full InChI is InChI=1S/C6H11NO/c1-6(2)5-8-4-3-7/h3-5H,7H2,1-2H3/b4-3-.
What are the key properties of (Z)-2-(2-methylprop-1-enoxy)ethenamine?
(Z)-2-(2-methylprop-1-enoxy)ethenamine has a molecular weight of 113.16 g/mol, XLogP of 1.36, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-(2-methylprop-1-enoxy)ethenamine is sourced from PubChem (CID 143419013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).