(Z)-3-methyl-6-methylideneoct-4-en-2-imine

C10H17N — CID 91496365

IUPAC(Z)-3-methyl-6-methylideneoct-4-en-2-imine
SMILES[H]/N=C(\C)C(C)/C=C\C(=C)CC
InChIInChI=1S/C10H17N/c1-5-8(2)6-7-9(3)10(4)11/h6-7,9,11H,2,5H2,1,3-4H3/b7-6-,11-10+
InChIKeyKOYJAPWFVYBEBF-JFEAUALZSA-N
MW151.25 g/mol
LogP3.18
Rot. Bonds4

About (Z)-3-methyl-6-methylideneoct-4-en-2-imine

(Z)-3-methyl-6-methylideneoct-4-en-2-imine (PubChem CID 91496365) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is (Z)-3-methyl-6-methylideneoct-4-en-2-imine.

Molecular Properties

Compound Name(Z)-3-methyl-6-methylideneoct-4-en-2-imine
PubChem CID91496365
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name(Z)-3-methyl-6-methylideneoct-4-en-2-imine
SMILES[H]/N=C(\C)C(C)/C=C\C(=C)CC
InChIInChI=1S/C10H17N/c1-5-8(2)6-7-9(3)10(4)11/h6-7,9,11H,2,5H2,1,3-4H3/b7-6-,11-10+
InChIKeyKOYJAPWFVYBEBF-JFEAUALZSA-N
XLogP3.18
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 ≤ 53.18
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

1-Methyl-2-imino-3,5-cyclohexadiene
CID 14398589
1-Ethyl-2-imino-3,5-cyclohexadiene
CID 85894878
3-Ethenyl-5-fluorohepta-3,5-dien-2-imine
CID 90894939
(3E,5Z)-9,9,9-trifluoro-4,8-dimethylnona-3,5-dien-2-imine
CID 91250232
5-Fluoro-6-methylhepta-4,6-dien-2-imine
CID 123502589
(5Z,7E)-8-fluoro-3-methylnona-5,7-dien-4-imine
CID 123873008
(5E,6Z)-5-ethylidene-8-fluoro-2-methylnona-2,6,8-trien-4-imine
CID 135254636
(3E,5E)-3-ethenyl-5-fluorohepta-3,5-dien-2-imine
CID 144000603
(2Z,4E,8E)-5-fluoro-6-methylidenetrideca-2,4,8-trien-7-imine
CID 155049255
(5E,7Z)-5-fluoro-4-methylidenenona-1,5,7-trien-3-imine
CID 155049266
(3Z,5E)-3-(fluoromethyl)-6-methylnona-3,5,8-trien-2-imine
CID 174316429
4-Methylcyclohexa-2,4-dien-1-imine
CID 14398593

Frequently Asked Questions

What is the IUPAC name of (Z)-3-methyl-6-methylideneoct-4-en-2-imine?
The IUPAC name of (Z)-3-methyl-6-methylideneoct-4-en-2-imine (CID 91496365) is (Z)-3-methyl-6-methylideneoct-4-en-2-imine.
What is the SMILES notation for (Z)-3-methyl-6-methylideneoct-4-en-2-imine?
The canonical SMILES for (Z)-3-methyl-6-methylideneoct-4-en-2-imine is [H]/N=C(\C)C(C)/C=C\C(=C)CC.
What is the InChIKey of (Z)-3-methyl-6-methylideneoct-4-en-2-imine?
The InChIKey is KOYJAPWFVYBEBF-JFEAUALZSA-N. The full InChI is InChI=1S/C10H17N/c1-5-8(2)6-7-9(3)10(4)11/h6-7,9,11H,2,5H2,1,3-4H3/b7-6-,11-10+.
What are the key properties of (Z)-3-methyl-6-methylideneoct-4-en-2-imine?
(Z)-3-methyl-6-methylideneoct-4-en-2-imine has a molecular weight of 151.25 g/mol, XLogP of 3.18, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-methyl-6-methylideneoct-4-en-2-imine is sourced from PubChem (CID 91496365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).