(6Z,8Z)-4-propylundeca-6,8,10-trien-1-imine

C14H23N — CID 88960923

IUPAC(6Z,8Z)-4-propylundeca-6,8,10-trien-1-imine
SMILES[H]/N=C/CCC(C/C=C\C=C/C=C)CCC
InChIInChI=1S/C14H23N/c1-3-5-6-7-8-11-14(10-4-2)12-9-13-15/h3,5-8,13-15H,1,4,9-12H2,2H3/b6-5-,8-7-,15-13+
InChIKeyNSQOPSKGZZVKPI-SRNJSQTFSA-N
MW205.35 g/mol
LogP4.52
Rot. Bonds9

About (6Z,8Z)-4-propylundeca-6,8,10-trien-1-imine

(6Z,8Z)-4-propylundeca-6,8,10-trien-1-imine (PubChem CID 88960923) has the molecular formula C14H23N and a molecular weight of 205.35 g/mol. Its IUPAC name is (6Z,8Z)-4-propylundeca-6,8,10-trien-1-imine.

Molecular Properties

Compound Name(6Z,8Z)-4-propylundeca-6,8,10-trien-1-imine
PubChem CID88960923
Molecular FormulaC14H23N
Molecular Weight205.35 g/mol
Exact Mass205.18
IUPAC Name(6Z,8Z)-4-propylundeca-6,8,10-trien-1-imine
SMILES[H]/N=C/CCC(C/C=C\C=C/C=C)CCC
InChIInChI=1S/C14H23N/c1-3-5-6-7-8-11-14(10-4-2)12-9-13-15/h3,5-8,13-15H,1,4,9-12H2,2H3/b6-5-,8-7-,15-13+
InChIKeyNSQOPSKGZZVKPI-SRNJSQTFSA-N
XLogP4.52
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.35
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (6Z,8Z)-4-propylundeca-6,8,10-trien-1-imine?
The IUPAC name of (6Z,8Z)-4-propylundeca-6,8,10-trien-1-imine (CID 88960923) is (6Z,8Z)-4-propylundeca-6,8,10-trien-1-imine.
What is the SMILES notation for (6Z,8Z)-4-propylundeca-6,8,10-trien-1-imine?
The canonical SMILES for (6Z,8Z)-4-propylundeca-6,8,10-trien-1-imine is [H]/N=C/CCC(C/C=C\C=C/C=C)CCC.
What is the InChIKey of (6Z,8Z)-4-propylundeca-6,8,10-trien-1-imine?
The InChIKey is NSQOPSKGZZVKPI-SRNJSQTFSA-N. The full InChI is InChI=1S/C14H23N/c1-3-5-6-7-8-11-14(10-4-2)12-9-13-15/h3,5-8,13-15H,1,4,9-12H2,2H3/b6-5-,8-7-,15-13+.
What are the key properties of (6Z,8Z)-4-propylundeca-6,8,10-trien-1-imine?
(6Z,8Z)-4-propylundeca-6,8,10-trien-1-imine has a molecular weight of 205.35 g/mol, XLogP of 4.52, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (6Z,8Z)-4-propylundeca-6,8,10-trien-1-imine is sourced from PubChem (CID 88960923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).