(Z)-N'-(3-ethenoxyprop-1-en-2-yl)ethene-1,2-diamine

C7H12N2O — CID 89016665

IUPAC(Z)-N'-(3-ethenoxyprop-1-en-2-yl)ethene-1,2-diamine
SMILESC=COCC(=C)N/C=C\N
InChIInChI=1S/C7H12N2O/c1-3-10-6-7(2)9-5-4-8/h3-5,9H,1-2,6,8H2/b5-4-
InChIKeyXAORNKWXGIEJJZ-PLNGDYQASA-N
MW140.19 g/mol
LogP0.68
Rot. Bonds5

About (Z)-N'-(3-ethenoxyprop-1-en-2-yl)ethene-1,2-diamine

(Z)-N'-(3-ethenoxyprop-1-en-2-yl)ethene-1,2-diamine (PubChem CID 89016665) has the molecular formula C7H12N2O and a molecular weight of 140.19 g/mol. Its IUPAC name is (Z)-N'-(3-ethenoxyprop-1-en-2-yl)ethene-1,2-diamine.

Molecular Properties

Compound Name(Z)-N'-(3-ethenoxyprop-1-en-2-yl)ethene-1,2-diamine
PubChem CID89016665
Molecular FormulaC7H12N2O
Molecular Weight140.19 g/mol
Exact Mass140.09
IUPAC Name(Z)-N'-(3-ethenoxyprop-1-en-2-yl)ethene-1,2-diamine
SMILESC=COCC(=C)N/C=C\N
InChIInChI=1S/C7H12N2O/c1-3-10-6-7(2)9-5-4-8/h3-5,9H,1-2,6,8H2/b5-4-
InChIKeyXAORNKWXGIEJJZ-PLNGDYQASA-N
XLogP0.68
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.19
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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)-N'-(3-ethenoxyprop-1-en-2-yl)ethene-1,2-diamine?
The IUPAC name of (Z)-N'-(3-ethenoxyprop-1-en-2-yl)ethene-1,2-diamine (CID 89016665) is (Z)-N'-(3-ethenoxyprop-1-en-2-yl)ethene-1,2-diamine.
What is the SMILES notation for (Z)-N'-(3-ethenoxyprop-1-en-2-yl)ethene-1,2-diamine?
The canonical SMILES for (Z)-N'-(3-ethenoxyprop-1-en-2-yl)ethene-1,2-diamine is C=COCC(=C)N/C=C\N.
What is the InChIKey of (Z)-N'-(3-ethenoxyprop-1-en-2-yl)ethene-1,2-diamine?
The InChIKey is XAORNKWXGIEJJZ-PLNGDYQASA-N. The full InChI is InChI=1S/C7H12N2O/c1-3-10-6-7(2)9-5-4-8/h3-5,9H,1-2,6,8H2/b5-4-.
What are the key properties of (Z)-N'-(3-ethenoxyprop-1-en-2-yl)ethene-1,2-diamine?
(Z)-N'-(3-ethenoxyprop-1-en-2-yl)ethene-1,2-diamine has a molecular weight of 140.19 g/mol, XLogP of 0.68, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N'-(3-ethenoxyprop-1-en-2-yl)ethene-1,2-diamine is sourced from PubChem (CID 89016665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).