(Z)-N-[(E)-ethylideneamino]-1-(methylideneamino)-N-[(Z)-prop-1-enyl]prop-1-en-1-amine

C9H15N3 — CID 137413283

IUPAC(Z)-N-[(E)-ethylideneamino]-1-(methylideneamino)-N-[(Z)-prop-1-enyl]prop-1-en-1-amine
SMILESC=N/C(=C/C)N(/C=C\C)/N=C/C
InChIInChI=1S/C9H15N3/c1-5-8-12(11-7-3)9(6-2)10-4/h5-8H,4H2,1-3H3/b8-5-,9-6-,11-7+
InChIKeyKNQDJBTVVDZOIU-OBMQQXOJSA-N
MW165.24 g/mol
LogP2.39
Rot. Bonds4

About (Z)-N-[(E)-ethylideneamino]-1-(methylideneamino)-N-[(Z)-prop-1-enyl]prop-1-en-1-amine

(Z)-N-[(E)-ethylideneamino]-1-(methylideneamino)-N-[(Z)-prop-1-enyl]prop-1-en-1-amine (PubChem CID 137413283) has the molecular formula C9H15N3 and a molecular weight of 165.24 g/mol. Its IUPAC name is (Z)-N-[(E)-ethylideneamino]-1-(methylideneamino)-N-[(Z)-prop-1-enyl]prop-1-en-1-amine.

Molecular Properties

Compound Name(Z)-N-[(E)-ethylideneamino]-1-(methylideneamino)-N-[(Z)-prop-1-enyl]prop-1-en-1-amine
PubChem CID137413283
Molecular FormulaC9H15N3
Molecular Weight165.24 g/mol
Exact Mass165.13
IUPAC Name(Z)-N-[(E)-ethylideneamino]-1-(methylideneamino)-N-[(Z)-prop-1-enyl]prop-1-en-1-amine
SMILESC=N/C(=C/C)N(/C=C\C)/N=C/C
InChIInChI=1S/C9H15N3/c1-5-8-12(11-7-3)9(6-2)10-4/h5-8H,4H2,1-3H3/b8-5-,9-6-,11-7+
InChIKeyKNQDJBTVVDZOIU-OBMQQXOJSA-N
XLogP2.39
TPSA27.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-N-[(E)-ethylideneamino]-1-(methylideneamino)-N-[(Z)-prop-1-enyl]prop-1-en-1-amine?
The IUPAC name of (Z)-N-[(E)-ethylideneamino]-1-(methylideneamino)-N-[(Z)-prop-1-enyl]prop-1-en-1-amine (CID 137413283) is (Z)-N-[(E)-ethylideneamino]-1-(methylideneamino)-N-[(Z)-prop-1-enyl]prop-1-en-1-amine.
What is the SMILES notation for (Z)-N-[(E)-ethylideneamino]-1-(methylideneamino)-N-[(Z)-prop-1-enyl]prop-1-en-1-amine?
The canonical SMILES for (Z)-N-[(E)-ethylideneamino]-1-(methylideneamino)-N-[(Z)-prop-1-enyl]prop-1-en-1-amine is C=N/C(=C/C)N(/C=C\C)/N=C/C.
What is the InChIKey of (Z)-N-[(E)-ethylideneamino]-1-(methylideneamino)-N-[(Z)-prop-1-enyl]prop-1-en-1-amine?
The InChIKey is KNQDJBTVVDZOIU-OBMQQXOJSA-N. The full InChI is InChI=1S/C9H15N3/c1-5-8-12(11-7-3)9(6-2)10-4/h5-8H,4H2,1-3H3/b8-5-,9-6-,11-7+.
What are the key properties of (Z)-N-[(E)-ethylideneamino]-1-(methylideneamino)-N-[(Z)-prop-1-enyl]prop-1-en-1-amine?
(Z)-N-[(E)-ethylideneamino]-1-(methylideneamino)-N-[(Z)-prop-1-enyl]prop-1-en-1-amine has a molecular weight of 165.24 g/mol, XLogP of 2.39, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-[(E)-ethylideneamino]-1-(methylideneamino)-N-[(Z)-prop-1-enyl]prop-1-en-1-amine is sourced from PubChem (CID 137413283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).