(4Z)-6,7-dimethylocta-4,6-dien-2-imine

C10H17N — CID 91246664

IUPAC(4Z)-6,7-dimethylocta-4,6-dien-2-imine
SMILES[H]/N=C(\C)C/C=C\C(C)=C(C)C
InChIInChI=1S/C10H17N/c1-8(2)9(3)6-5-7-10(4)11/h5-6,11H,7H2,1-4H3/b6-5-,11-10+
InChIKeyPCNKVWMADHSEDL-GWZUCBFCSA-N
MW151.25 g/mol
LogP3.33
Rot. Bonds3

About (4Z)-6,7-dimethylocta-4,6-dien-2-imine

(4Z)-6,7-dimethylocta-4,6-dien-2-imine (PubChem CID 91246664) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is (4Z)-6,7-dimethylocta-4,6-dien-2-imine.

Molecular Properties

Compound Name(4Z)-6,7-dimethylocta-4,6-dien-2-imine
PubChem CID91246664
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name(4Z)-6,7-dimethylocta-4,6-dien-2-imine
SMILES[H]/N=C(\C)C/C=C\C(C)=C(C)C
InChIInChI=1S/C10H17N/c1-8(2)9(3)6-5-7-10(4)11/h5-6,11H,7H2,1-4H3/b6-5-,11-10+
InChIKeyPCNKVWMADHSEDL-GWZUCBFCSA-N
XLogP3.33
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
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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Related Compounds

6-Methylenecyclohexa-2,4-dienimine
CID 10909510
Toluquinone diimine
CID 57641797
(4-Propan-2-ylidenecyclohexa-2,5-dien-1-ylidene)azanium
CID 86016874
3-Ethenyl-5-fluorohepta-3,5-dien-2-imine
CID 90894939
(4Z)-6,7-difluoroocta-4,6-dien-2-imine
CID 123446884
5-Fluoro-6-methylhepta-4,6-dien-2-imine
CID 123502589
(3E,5Z)-3-ethylidene-5-[(E)-1-fluoroprop-1-enyl]octa-1,5,7-trien-4-imine
CID 132066393
(3Z,5E)-5-fluoro-3-methylhepta-3,5-dien-2-imine
CID 134217364
4-Fluoro-6-propan-2-ylidenecyclohexa-2,4-dien-1-imine
CID 134381223
(5E,6Z)-5-ethylidene-8-fluoro-2-methylnona-2,6,8-trien-4-imine
CID 135254636
(Z)-2,2-difluoro-7-methylidenedec-5-en-4-imine
CID 143588764
(3E,5E)-3-ethenyl-5-fluorohepta-3,5-dien-2-imine
CID 144000603

Frequently Asked Questions

What is the IUPAC name of (4Z)-6,7-dimethylocta-4,6-dien-2-imine?
The IUPAC name of (4Z)-6,7-dimethylocta-4,6-dien-2-imine (CID 91246664) is (4Z)-6,7-dimethylocta-4,6-dien-2-imine.
What is the SMILES notation for (4Z)-6,7-dimethylocta-4,6-dien-2-imine?
The canonical SMILES for (4Z)-6,7-dimethylocta-4,6-dien-2-imine is [H]/N=C(\C)C/C=C\C(C)=C(C)C.
What is the InChIKey of (4Z)-6,7-dimethylocta-4,6-dien-2-imine?
The InChIKey is PCNKVWMADHSEDL-GWZUCBFCSA-N. The full InChI is InChI=1S/C10H17N/c1-8(2)9(3)6-5-7-10(4)11/h5-6,11H,7H2,1-4H3/b6-5-,11-10+.
What are the key properties of (4Z)-6,7-dimethylocta-4,6-dien-2-imine?
(4Z)-6,7-dimethylocta-4,6-dien-2-imine has a molecular weight of 151.25 g/mol, XLogP of 3.33, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z)-6,7-dimethylocta-4,6-dien-2-imine is sourced from PubChem (CID 91246664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).