(Z)-3-ethenyliminopent-1-ene-1,5-diamine

C7H13N3 — CID 89018201

IUPAC(Z)-3-ethenyliminopent-1-ene-1,5-diamine
SMILESC=C/N=C(/C=C\N)CCN
InChIInChI=1S/C7H13N3/c1-2-10-7(3-5-8)4-6-9/h2-3,5H,1,4,6,8-9H2/b5-3-,10-7-
InChIKeyULWKDERAEJQIMF-TYWVWOHTSA-N
MW139.20 g/mol
LogP0.39
Rot. Bonds4

About (Z)-3-ethenyliminopent-1-ene-1,5-diamine

(Z)-3-ethenyliminopent-1-ene-1,5-diamine (PubChem CID 89018201) has the molecular formula C7H13N3 and a molecular weight of 139.20 g/mol. Its IUPAC name is (Z)-3-ethenyliminopent-1-ene-1,5-diamine.

Molecular Properties

Compound Name(Z)-3-ethenyliminopent-1-ene-1,5-diamine
PubChem CID89018201
Molecular FormulaC7H13N3
Molecular Weight139.20 g/mol
Exact Mass139.11
IUPAC Name(Z)-3-ethenyliminopent-1-ene-1,5-diamine
SMILESC=C/N=C(/C=C\N)CCN
InChIInChI=1S/C7H13N3/c1-2-10-7(3-5-8)4-6-9/h2-3,5H,1,4,6,8-9H2/b5-3-,10-7-
InChIKeyULWKDERAEJQIMF-TYWVWOHTSA-N
XLogP0.39
TPSA64.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

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CID 58427153
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2-(3,4-dihydro-2H-pyrrol-5-yl)ethenamine
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iron;2H-pyridin-2-ide-3,4-diimine
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(Z)-3-ethenyliminobut-1-en-1-amine
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(Z)-2-(but-3-en-2-ylideneamino)ethenamine
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Frequently Asked Questions

What is the IUPAC name of (Z)-3-ethenyliminopent-1-ene-1,5-diamine?
The IUPAC name of (Z)-3-ethenyliminopent-1-ene-1,5-diamine (CID 89018201) is (Z)-3-ethenyliminopent-1-ene-1,5-diamine.
What is the SMILES notation for (Z)-3-ethenyliminopent-1-ene-1,5-diamine?
The canonical SMILES for (Z)-3-ethenyliminopent-1-ene-1,5-diamine is C=C/N=C(/C=C\N)CCN.
What is the InChIKey of (Z)-3-ethenyliminopent-1-ene-1,5-diamine?
The InChIKey is ULWKDERAEJQIMF-TYWVWOHTSA-N. The full InChI is InChI=1S/C7H13N3/c1-2-10-7(3-5-8)4-6-9/h2-3,5H,1,4,6,8-9H2/b5-3-,10-7-.
What are the key properties of (Z)-3-ethenyliminopent-1-ene-1,5-diamine?
(Z)-3-ethenyliminopent-1-ene-1,5-diamine has a molecular weight of 139.20 g/mol, XLogP of 0.39, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-ethenyliminopent-1-ene-1,5-diamine is sourced from PubChem (CID 89018201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).