N,N'-dipentylpent-2-ene-1,5-diimine

C15H28N2 — CID 54354710

IUPACN,N'-dipentylpent-2-ene-1,5-diimine
SMILESCCCCC/N=C/C=CC/C=N/CCCCC
InChIInChI=1S/C15H28N2/c1-3-5-8-12-16-14-10-7-11-15-17-13-9-6-4-2/h7,10,14-15H,3-6,8-9,11-13H2,1-2H3/b10-7?,16-14+,17-15+
InChIKeyUIHOEQVRFKDVDA-UICQRCIJSA-N
MW236.40 g/mol
LogP4.45
Rot. Bonds11

About N,N'-dipentylpent-2-ene-1,5-diimine

N,N'-dipentylpent-2-ene-1,5-diimine (PubChem CID 54354710) has the molecular formula C15H28N2 and a molecular weight of 236.40 g/mol. Its IUPAC name is N,N'-dipentylpent-2-ene-1,5-diimine.

Molecular Properties

Compound NameN,N'-dipentylpent-2-ene-1,5-diimine
PubChem CID54354710
Molecular FormulaC15H28N2
Molecular Weight236.40 g/mol
Exact Mass236.23
IUPAC NameN,N'-dipentylpent-2-ene-1,5-diimine
SMILESCCCCC/N=C/C=CC/C=N/CCCCC
InChIInChI=1S/C15H28N2/c1-3-5-8-12-16-14-10-7-11-15-17-13-9-6-4-2/h7,10,14-15H,3-6,8-9,11-13H2,1-2H3/b10-7?,16-14+,17-15+
InChIKeyUIHOEQVRFKDVDA-UICQRCIJSA-N
XLogP4.45
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.40
LogP ≤ 54.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N'-dipentylpent-2-ene-1,5-diimine?
The IUPAC name of N,N'-dipentylpent-2-ene-1,5-diimine (CID 54354710) is N,N'-dipentylpent-2-ene-1,5-diimine.
What is the SMILES notation for N,N'-dipentylpent-2-ene-1,5-diimine?
The canonical SMILES for N,N'-dipentylpent-2-ene-1,5-diimine is CCCCC/N=C/C=CC/C=N/CCCCC.
What is the InChIKey of N,N'-dipentylpent-2-ene-1,5-diimine?
The InChIKey is UIHOEQVRFKDVDA-UICQRCIJSA-N. The full InChI is InChI=1S/C15H28N2/c1-3-5-8-12-16-14-10-7-11-15-17-13-9-6-4-2/h7,10,14-15H,3-6,8-9,11-13H2,1-2H3/b10-7?,16-14+,17-15+.
What are the key properties of N,N'-dipentylpent-2-ene-1,5-diimine?
N,N'-dipentylpent-2-ene-1,5-diimine has a molecular weight of 236.40 g/mol, XLogP of 4.45, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-dipentylpent-2-ene-1,5-diimine is sourced from PubChem (CID 54354710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).