(E)-N,2-dimethyl-6-methylidene-4-propyloct-4-en-3-imine

C14H25N — CID 134380298

IUPAC(E)-N,2-dimethyl-6-methylidene-4-propyloct-4-en-3-imine
SMILESC=C(/C=C(CCC)/C(=N/C)C(C)C)CC
InChIInChI=1S/C14H25N/c1-7-9-13(10-12(5)8-2)14(15-6)11(3)4/h10-11H,5,7-9H2,1-4,6H3/b13-10+,15-14+
InChIKeyGBZFXJBRLHKMPN-HFEXRDJISA-N
MW207.36 g/mol
LogP4.41
Rot. Bonds6

About (E)-N,2-dimethyl-6-methylidene-4-propyloct-4-en-3-imine

(E)-N,2-dimethyl-6-methylidene-4-propyloct-4-en-3-imine (PubChem CID 134380298) has the molecular formula C14H25N and a molecular weight of 207.36 g/mol. Its IUPAC name is (E)-N,2-dimethyl-6-methylidene-4-propyloct-4-en-3-imine.

Molecular Properties

Compound Name(E)-N,2-dimethyl-6-methylidene-4-propyloct-4-en-3-imine
PubChem CID134380298
Molecular FormulaC14H25N
Molecular Weight207.36 g/mol
Exact Mass207.20
IUPAC Name(E)-N,2-dimethyl-6-methylidene-4-propyloct-4-en-3-imine
SMILESC=C(/C=C(CCC)/C(=N/C)C(C)C)CC
InChIInChI=1S/C14H25N/c1-7-9-13(10-12(5)8-2)14(15-6)11(3)4/h10-11H,5,7-9H2,1-4,6H3/b13-10+,15-14+
InChIKeyGBZFXJBRLHKMPN-HFEXRDJISA-N
XLogP4.41
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.36
LogP ≤ 54.41
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

N-[(Z)-2-ethyl-4-methyl-3-methylidenepent-1-enyl]methanimine
CID 145384898
N,2,4-trimethyloct-1-en-3-imine
CID 123513691
(3Z)-4-propan-2-ylhepta-1,3-dien-2-amine
CID 129269311
(Z,2S)-4-ethyl-3-methyliminohex-4-en-2-amine
CID 166949543
(2Z,4Z)-3-ethyl-4-methyl-6-methylidenenona-2,4-diene
CID 171555067
2-methyl-3,4-dimethylideneoctane
CID 134835282
(E)-N,2,5-trimethyldec-4-en-3-imine
CID 166992287
(Z)-2-methyl-5-methylideneoct-3-ene
CID 143255945
(3E)-3-ethylidene-2-methylhex-1-ene
CID 143524978
N'-methyl-N-(5-methyl-4-methylidenehexan-3-ylidene)methanimidamide
CID 165130850
ethane;(E)-4-ethyl-2-methyl-6-methylideneoct-4-ene;7-methylidenedodec-1-ene
CID 143261188
(E)-4-methylidenehex-2-ene-1,2-diol
CID 88543439

Frequently Asked Questions

What is the IUPAC name of (E)-N,2-dimethyl-6-methylidene-4-propyloct-4-en-3-imine?
The IUPAC name of (E)-N,2-dimethyl-6-methylidene-4-propyloct-4-en-3-imine (CID 134380298) is (E)-N,2-dimethyl-6-methylidene-4-propyloct-4-en-3-imine.
What is the SMILES notation for (E)-N,2-dimethyl-6-methylidene-4-propyloct-4-en-3-imine?
The canonical SMILES for (E)-N,2-dimethyl-6-methylidene-4-propyloct-4-en-3-imine is C=C(/C=C(CCC)/C(=N/C)C(C)C)CC.
What is the InChIKey of (E)-N,2-dimethyl-6-methylidene-4-propyloct-4-en-3-imine?
The InChIKey is GBZFXJBRLHKMPN-HFEXRDJISA-N. The full InChI is InChI=1S/C14H25N/c1-7-9-13(10-12(5)8-2)14(15-6)11(3)4/h10-11H,5,7-9H2,1-4,6H3/b13-10+,15-14+.
What are the key properties of (E)-N,2-dimethyl-6-methylidene-4-propyloct-4-en-3-imine?
(E)-N,2-dimethyl-6-methylidene-4-propyloct-4-en-3-imine has a molecular weight of 207.36 g/mol, XLogP of 4.41, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N,2-dimethyl-6-methylidene-4-propyloct-4-en-3-imine is sourced from PubChem (CID 134380298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).