(Z,3Z)-3-butan-2-ylidene-N-methyl-6-methylideneoct-4-en-1-imine

C14H23N — CID 134478047

IUPAC(Z,3Z)-3-butan-2-ylidene-N-methyl-6-methylideneoct-4-en-1-imine
SMILESC=C(/C=C\C(C/C=N/C)=C(\C)CC)CC
InChIInChI=1S/C14H23N/c1-6-12(3)8-9-14(10-11-15-5)13(4)7-2/h8-9,11H,3,6-7,10H2,1-2,4-5H3/b9-8-,14-13+,15-11+
InChIKeyRVPJEOOGYAEVDR-GFOPOWLCSA-N
MW205.34 g/mol
LogP4.33
Rot. Bonds6

About (Z,3Z)-3-butan-2-ylidene-N-methyl-6-methylideneoct-4-en-1-imine

(Z,3Z)-3-butan-2-ylidene-N-methyl-6-methylideneoct-4-en-1-imine (PubChem CID 134478047) has the molecular formula C14H23N and a molecular weight of 205.34 g/mol. Its IUPAC name is (Z,3Z)-3-butan-2-ylidene-N-methyl-6-methylideneoct-4-en-1-imine.

Molecular Properties

Compound Name(Z,3Z)-3-butan-2-ylidene-N-methyl-6-methylideneoct-4-en-1-imine
PubChem CID134478047
Molecular FormulaC14H23N
Molecular Weight205.34 g/mol
Exact Mass205.18
IUPAC Name(Z,3Z)-3-butan-2-ylidene-N-methyl-6-methylideneoct-4-en-1-imine
SMILESC=C(/C=C\C(C/C=N/C)=C(\C)CC)CC
InChIInChI=1S/C14H23N/c1-6-12(3)8-9-14(10-11-15-5)13(4)7-2/h8-9,11H,3,6-7,10H2,1-2,4-5H3/b9-8-,14-13+,15-11+
InChIKeyRVPJEOOGYAEVDR-GFOPOWLCSA-N
XLogP4.33
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.34
LogP ≤ 54.33
H-Bond Donors ≤ 50
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

(Z)-5-methylidenehept-3-en-2-one
CID 123321874
2-bromo-5-methylidenehepta-1,3-diene
CID 123950056
(Z)-1,1,1-trifluoro-N-methyl-5-methylidenehept-3-en-2-imine
CID 169163898
(2Z,4Z)-2-chloro-6-methylideneocta-2,4-dien-3-ol
CID 142113261
ethene;(3Z,7Z)-2-methyl-5,6,9-trimethylideneundeca-1,3,7-triene
CID 145059823
(3Z,7Z)-2-methyl-5,6,9-trimethylideneundeca-1,3,7-triene;propane
CID 144723415
(Z)-2,3,6-trimethylidene-N-prop-1-en-2-yloct-4-en-1-imine
CID 145480541
prop-1-ene;(4Z,8Z)-3,6,7,10-tetramethylidenedodeca-4,8-diene
CID 144612607
(E)-3-methylidenepent-1-en-1-amine
CID 154554960
5-methylidene-2-(trifluoromethyl)hepta-1,3-diene
CID 91256552
propane;(3Z,7Z)-5,6,9-trimethylideneundeca-1,3,7-trien-2-ol
CID 142281411
methane;(4Z)-2-methyl-6-methylideneocta-2,4-diene
CID 145083529

Frequently Asked Questions

What is the IUPAC name of (Z,3Z)-3-butan-2-ylidene-N-methyl-6-methylideneoct-4-en-1-imine?
The IUPAC name of (Z,3Z)-3-butan-2-ylidene-N-methyl-6-methylideneoct-4-en-1-imine (CID 134478047) is (Z,3Z)-3-butan-2-ylidene-N-methyl-6-methylideneoct-4-en-1-imine.
What is the SMILES notation for (Z,3Z)-3-butan-2-ylidene-N-methyl-6-methylideneoct-4-en-1-imine?
The canonical SMILES for (Z,3Z)-3-butan-2-ylidene-N-methyl-6-methylideneoct-4-en-1-imine is C=C(/C=C\C(C/C=N/C)=C(\C)CC)CC.
What is the InChIKey of (Z,3Z)-3-butan-2-ylidene-N-methyl-6-methylideneoct-4-en-1-imine?
The InChIKey is RVPJEOOGYAEVDR-GFOPOWLCSA-N. The full InChI is InChI=1S/C14H23N/c1-6-12(3)8-9-14(10-11-15-5)13(4)7-2/h8-9,11H,3,6-7,10H2,1-2,4-5H3/b9-8-,14-13+,15-11+.
What are the key properties of (Z,3Z)-3-butan-2-ylidene-N-methyl-6-methylideneoct-4-en-1-imine?
(Z,3Z)-3-butan-2-ylidene-N-methyl-6-methylideneoct-4-en-1-imine has a molecular weight of 205.34 g/mol, XLogP of 4.33, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z,3Z)-3-butan-2-ylidene-N-methyl-6-methylideneoct-4-en-1-imine is sourced from PubChem (CID 134478047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).