(Z)-N,2,2,7,7-pentamethyl-6-methylideneoct-4-en-3-imine

C14H25N — CID 169243501

IUPAC(Z)-N,2,2,7,7-pentamethyl-6-methylideneoct-4-en-3-imine
SMILESC=C(/C=C\C(=N\C)C(C)(C)C)C(C)(C)C
InChIInChI=1S/C14H25N/c1-11(13(2,3)4)9-10-12(15-8)14(5,6)7/h9-10H,1H2,2-8H3/b10-9-,15-12-
InChIKeyMHMSXJOENBFEBZ-UWAUXONXSA-N
MW207.36 g/mol
LogP4.26
Rot. Bonds2

About (Z)-N,2,2,7,7-pentamethyl-6-methylideneoct-4-en-3-imine

(Z)-N,2,2,7,7-pentamethyl-6-methylideneoct-4-en-3-imine (PubChem CID 169243501) has the molecular formula C14H25N and a molecular weight of 207.36 g/mol. Its IUPAC name is (Z)-N,2,2,7,7-pentamethyl-6-methylideneoct-4-en-3-imine.

Molecular Properties

Compound Name(Z)-N,2,2,7,7-pentamethyl-6-methylideneoct-4-en-3-imine
PubChem CID169243501
Molecular FormulaC14H25N
Molecular Weight207.36 g/mol
Exact Mass207.20
IUPAC Name(Z)-N,2,2,7,7-pentamethyl-6-methylideneoct-4-en-3-imine
SMILESC=C(/C=C\C(=N\C)C(C)(C)C)C(C)(C)C
InChIInChI=1S/C14H25N/c1-11(13(2,3)4)9-10-12(15-8)14(5,6)7/h9-10H,1H2,2-8H3/b10-9-,15-12-
InChIKeyMHMSXJOENBFEBZ-UWAUXONXSA-N
XLogP4.26
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.36
LogP ≤ 54.26
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)-3-N,4,4-trimethyl-1-N-methylidenepent-1-ene-1,3-diimine
CID 87414942
(Z)-N,2,2-trimethylhept-4-en-6-yn-3-imine
CID 130238736
N,2,2,5,6,6-hexamethylhept-4-en-3-imine
CID 123161539
(E)-2,2,6,6-tetramethyl-5-methylidenehept-3-ene
CID 5463033
2-tert-butylsulfanyl-6,6-dimethyl-5-methylidenehepta-1,3-diene
CID 123259234
6,6-dimethyl-5-methylidenehepta-1,3-diene
CID 72571250
(Z)-1,1,1-trifluoro-N-methyl-5-methylidenehept-3-en-2-imine
CID 169163898
2-methyl-3-methyliminopent-4-en-2-ol
CID 145069918
(4Z)-2-methyl-3-methyliminohepta-4,6-dien-2-amine
CID 170583082
(Z)-N-ethenyl-2,2-dimethylhex-4-en-3-imine
CID 129035901
(Z)-9,9-dimethyl-8-methylidenedec-6-en-5-one
CID 91607880
(E)-5,5-dimethyl-4-methylidenehex-2-en-2-amine
CID 142985174

Frequently Asked Questions

What is the IUPAC name of (Z)-N,2,2,7,7-pentamethyl-6-methylideneoct-4-en-3-imine?
The IUPAC name of (Z)-N,2,2,7,7-pentamethyl-6-methylideneoct-4-en-3-imine (CID 169243501) is (Z)-N,2,2,7,7-pentamethyl-6-methylideneoct-4-en-3-imine.
What is the SMILES notation for (Z)-N,2,2,7,7-pentamethyl-6-methylideneoct-4-en-3-imine?
The canonical SMILES for (Z)-N,2,2,7,7-pentamethyl-6-methylideneoct-4-en-3-imine is C=C(/C=C\C(=N\C)C(C)(C)C)C(C)(C)C.
What is the InChIKey of (Z)-N,2,2,7,7-pentamethyl-6-methylideneoct-4-en-3-imine?
The InChIKey is MHMSXJOENBFEBZ-UWAUXONXSA-N. The full InChI is InChI=1S/C14H25N/c1-11(13(2,3)4)9-10-12(15-8)14(5,6)7/h9-10H,1H2,2-8H3/b10-9-,15-12-.
What are the key properties of (Z)-N,2,2,7,7-pentamethyl-6-methylideneoct-4-en-3-imine?
(Z)-N,2,2,7,7-pentamethyl-6-methylideneoct-4-en-3-imine has a molecular weight of 207.36 g/mol, XLogP of 4.26, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N,2,2,7,7-pentamethyl-6-methylideneoct-4-en-3-imine is sourced from PubChem (CID 169243501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).