(5Z)-5,7-dimethylocta-5,7-dien-4-imine

C10H17N — CID 135190093

IUPAC(5Z)-5,7-dimethylocta-5,7-dien-4-imine
SMILES[H]/N=C(CCC)/C(C)=C\C(=C)C
InChIInChI=1S/C10H17N/c1-5-6-10(11)9(4)7-8(2)3/h7,11H,2,5-6H2,1,3-4H3/b9-7-,11-10+
InChIKeyRMDQDFHLENKTNT-NKTIYDDZSA-N
MW151.25 g/mol
LogP3.33
Rot. Bonds4

About (5Z)-5,7-dimethylocta-5,7-dien-4-imine

(5Z)-5,7-dimethylocta-5,7-dien-4-imine (PubChem CID 135190093) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is (5Z)-5,7-dimethylocta-5,7-dien-4-imine.

Molecular Properties

Compound Name(5Z)-5,7-dimethylocta-5,7-dien-4-imine
PubChem CID135190093
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name(5Z)-5,7-dimethylocta-5,7-dien-4-imine
SMILES[H]/N=C(CCC)/C(C)=C\C(=C)C
InChIInChI=1S/C10H17N/c1-5-6-10(11)9(4)7-8(2)3/h7,11H,2,5-6H2,1,3-4H3/b9-7-,11-10+
InChIKeyRMDQDFHLENKTNT-NKTIYDDZSA-N
XLogP3.33
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 53.33
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 (5Z)-5,7-dimethylocta-5,7-dien-4-imine?
The IUPAC name of (5Z)-5,7-dimethylocta-5,7-dien-4-imine (CID 135190093) is (5Z)-5,7-dimethylocta-5,7-dien-4-imine.
What is the SMILES notation for (5Z)-5,7-dimethylocta-5,7-dien-4-imine?
The canonical SMILES for (5Z)-5,7-dimethylocta-5,7-dien-4-imine is [H]/N=C(CCC)/C(C)=C\C(=C)C.
What is the InChIKey of (5Z)-5,7-dimethylocta-5,7-dien-4-imine?
The InChIKey is RMDQDFHLENKTNT-NKTIYDDZSA-N. The full InChI is InChI=1S/C10H17N/c1-5-6-10(11)9(4)7-8(2)3/h7,11H,2,5-6H2,1,3-4H3/b9-7-,11-10+.
What are the key properties of (5Z)-5,7-dimethylocta-5,7-dien-4-imine?
(5Z)-5,7-dimethylocta-5,7-dien-4-imine has a molecular weight of 151.25 g/mol, XLogP of 3.33, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-5,7-dimethylocta-5,7-dien-4-imine is sourced from PubChem (CID 135190093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).