(Z)-N-[(1E)-penta-1,4-dienyl]pent-2-en-1-imine

C10H15N — CID 137383458

IUPAC(Z)-N-[(1E)-penta-1,4-dienyl]pent-2-en-1-imine
SMILESC=CC/C=C/N=C/C=C\CC
InChIInChI=1S/C10H15N/c1-3-5-7-9-11-10-8-6-4-2/h3,6-10H,1,4-5H2,2H3/b8-6-,9-7+,11-10+
InChIKeyLFNHMOZJNDWREY-LFWNISHGSA-N
MW149.24 g/mol
LogP3.11
Rot. Bonds5

About (Z)-N-[(1E)-penta-1,4-dienyl]pent-2-en-1-imine

(Z)-N-[(1E)-penta-1,4-dienyl]pent-2-en-1-imine (PubChem CID 137383458) has the molecular formula C10H15N and a molecular weight of 149.24 g/mol. Its IUPAC name is (Z)-N-[(1E)-penta-1,4-dienyl]pent-2-en-1-imine.

Molecular Properties

Compound Name(Z)-N-[(1E)-penta-1,4-dienyl]pent-2-en-1-imine
PubChem CID137383458
Molecular FormulaC10H15N
Molecular Weight149.24 g/mol
Exact Mass149.12
IUPAC Name(Z)-N-[(1E)-penta-1,4-dienyl]pent-2-en-1-imine
SMILESC=CC/C=C/N=C/C=C\CC
InChIInChI=1S/C10H15N/c1-3-5-7-9-11-10-8-6-4-2/h3,6-10H,1,4-5H2,2H3/b8-6-,9-7+,11-10+
InChIKeyLFNHMOZJNDWREY-LFWNISHGSA-N
XLogP3.11
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.24
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-N-[(1E)-penta-1,4-dienyl]pent-2-en-1-imine?
The IUPAC name of (Z)-N-[(1E)-penta-1,4-dienyl]pent-2-en-1-imine (CID 137383458) is (Z)-N-[(1E)-penta-1,4-dienyl]pent-2-en-1-imine.
What is the SMILES notation for (Z)-N-[(1E)-penta-1,4-dienyl]pent-2-en-1-imine?
The canonical SMILES for (Z)-N-[(1E)-penta-1,4-dienyl]pent-2-en-1-imine is C=CC/C=C/N=C/C=C\CC.
What is the InChIKey of (Z)-N-[(1E)-penta-1,4-dienyl]pent-2-en-1-imine?
The InChIKey is LFNHMOZJNDWREY-LFWNISHGSA-N. The full InChI is InChI=1S/C10H15N/c1-3-5-7-9-11-10-8-6-4-2/h3,6-10H,1,4-5H2,2H3/b8-6-,9-7+,11-10+.
What are the key properties of (Z)-N-[(1E)-penta-1,4-dienyl]pent-2-en-1-imine?
(Z)-N-[(1E)-penta-1,4-dienyl]pent-2-en-1-imine has a molecular weight of 149.24 g/mol, XLogP of 3.11, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-[(1E)-penta-1,4-dienyl]pent-2-en-1-imine is sourced from PubChem (CID 137383458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).