(Z)-N-[(Z)-[(Z)-4-iminopent-2-enylidene]amino]prop-1-en-1-amine

C8H13N3 — CID 88894768

IUPAC(Z)-N-[(Z)-[(Z)-4-iminopent-2-enylidene]amino]prop-1-en-1-amine
SMILES[H]/N=C(C)/C=C\C=N/N/C=C\C
InChIInChI=1S/C8H13N3/c1-3-6-10-11-7-4-5-8(2)9/h3-7,9-10H,1-2H3/b5-4-,6-3-,9-8+,11-7-
InChIKeyLAOVYFAHKJBZBF-CUMVBHHVSA-N
MW151.21 g/mol
LogP1.69
Rot. Bonds4

About (Z)-N-[(Z)-[(Z)-4-iminopent-2-enylidene]amino]prop-1-en-1-amine

(Z)-N-[(Z)-[(Z)-4-iminopent-2-enylidene]amino]prop-1-en-1-amine (PubChem CID 88894768) has the molecular formula C8H13N3 and a molecular weight of 151.21 g/mol. Its IUPAC name is (Z)-N-[(Z)-[(Z)-4-iminopent-2-enylidene]amino]prop-1-en-1-amine.

Molecular Properties

Compound Name(Z)-N-[(Z)-[(Z)-4-iminopent-2-enylidene]amino]prop-1-en-1-amine
PubChem CID88894768
Molecular FormulaC8H13N3
Molecular Weight151.21 g/mol
Exact Mass151.11
IUPAC Name(Z)-N-[(Z)-[(Z)-4-iminopent-2-enylidene]amino]prop-1-en-1-amine
SMILES[H]/N=C(C)/C=C\C=N/N/C=C\C
InChIInChI=1S/C8H13N3/c1-3-6-10-11-7-4-5-8(2)9/h3-7,9-10H,1-2H3/b5-4-,6-3-,9-8+,11-7-
InChIKeyLAOVYFAHKJBZBF-CUMVBHHVSA-N
XLogP1.69
TPSA48.24 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.69
H-Bond Donors ≤ 52
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-[(Z)-[(Z)-4-iminopent-2-enylidene]amino]prop-1-en-1-amine?
The IUPAC name of (Z)-N-[(Z)-[(Z)-4-iminopent-2-enylidene]amino]prop-1-en-1-amine (CID 88894768) is (Z)-N-[(Z)-[(Z)-4-iminopent-2-enylidene]amino]prop-1-en-1-amine.
What is the SMILES notation for (Z)-N-[(Z)-[(Z)-4-iminopent-2-enylidene]amino]prop-1-en-1-amine?
The canonical SMILES for (Z)-N-[(Z)-[(Z)-4-iminopent-2-enylidene]amino]prop-1-en-1-amine is [H]/N=C(C)/C=C\C=N/N/C=C\C.
What is the InChIKey of (Z)-N-[(Z)-[(Z)-4-iminopent-2-enylidene]amino]prop-1-en-1-amine?
The InChIKey is LAOVYFAHKJBZBF-CUMVBHHVSA-N. The full InChI is InChI=1S/C8H13N3/c1-3-6-10-11-7-4-5-8(2)9/h3-7,9-10H,1-2H3/b5-4-,6-3-,9-8+,11-7-.
What are the key properties of (Z)-N-[(Z)-[(Z)-4-iminopent-2-enylidene]amino]prop-1-en-1-amine?
(Z)-N-[(Z)-[(Z)-4-iminopent-2-enylidene]amino]prop-1-en-1-amine has a molecular weight of 151.21 g/mol, XLogP of 1.69, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-[(Z)-[(Z)-4-iminopent-2-enylidene]amino]prop-1-en-1-amine is sourced from PubChem (CID 88894768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).