(E)-4-methoxy-N-methylhex-3-en-2-imine

C8H15NO — CID 123311460

IUPAC(E)-4-methoxy-N-methylhex-3-en-2-imine
SMILESCC/C(=C\C(C)=N\C)OC
InChIInChI=1S/C8H15NO/c1-5-8(10-4)6-7(2)9-3/h6H,5H2,1-4H3/b8-6+,9-7+
InChIKeyGICUATAZOVBLLX-CDJQDVQCSA-N
MW141.21 g/mol
LogP2.02
Rot. Bonds3

About (E)-4-methoxy-N-methylhex-3-en-2-imine

(E)-4-methoxy-N-methylhex-3-en-2-imine (PubChem CID 123311460) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is (E)-4-methoxy-N-methylhex-3-en-2-imine.

Molecular Properties

Compound Name(E)-4-methoxy-N-methylhex-3-en-2-imine
PubChem CID123311460
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name(E)-4-methoxy-N-methylhex-3-en-2-imine
SMILESCC/C(=C\C(C)=N\C)OC
InChIInChI=1S/C8H15NO/c1-5-8(10-4)6-7(2)9-3/h6H,5H2,1-4H3/b8-6+,9-7+
InChIKeyGICUATAZOVBLLX-CDJQDVQCSA-N
XLogP2.02
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 52.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

(Z)-1,1,1-trifluoro-4-methoxy-N-methylpent-3-en-2-imine
CID 59782224
1,1,1-trifluoro-4-methoxy-N-methylpent-3-en-2-imine
CID 72560400
(Z)-1-fluoro-4-methoxy-N-methylpent-3-en-2-imine
CID 88941554
(Z)-1,5-difluoro-4-methoxy-N-methylpent-3-en-2-imine
CID 89226253
InChI=1/C9H14NO/c1-7-5-9(10(3)4)6-8(2)11-7/h5-6H,1-4H3/q+
CID 5325147
(2,6-Dimethylpyran-4-ylidene)-dimethylazanium iodide
CID 10826500
(Z)-4-methoxypent-3-en-2-imine
CID 12462133
(E)-4-methoxy-N-methylpent-3-en-2-imine
CID 53982430
(Z)-4-methyliminopent-2-en-2-olate
CID 58104808
4,6-dimethyl-2H-1,3-oxazine
CID 59189020
(Z)-5-methoxy-N,2,2-trimethylhex-4-en-3-imine
CID 59782172
(Z)-4-methoxy-N-methylpent-3-en-2-imine
CID 59782201

Frequently Asked Questions

What is the IUPAC name of (E)-4-methoxy-N-methylhex-3-en-2-imine?
The IUPAC name of (E)-4-methoxy-N-methylhex-3-en-2-imine (CID 123311460) is (E)-4-methoxy-N-methylhex-3-en-2-imine.
What is the SMILES notation for (E)-4-methoxy-N-methylhex-3-en-2-imine?
The canonical SMILES for (E)-4-methoxy-N-methylhex-3-en-2-imine is CC/C(=C\C(C)=N\C)OC.
What is the InChIKey of (E)-4-methoxy-N-methylhex-3-en-2-imine?
The InChIKey is GICUATAZOVBLLX-CDJQDVQCSA-N. The full InChI is InChI=1S/C8H15NO/c1-5-8(10-4)6-7(2)9-3/h6H,5H2,1-4H3/b8-6+,9-7+.
What are the key properties of (E)-4-methoxy-N-methylhex-3-en-2-imine?
(E)-4-methoxy-N-methylhex-3-en-2-imine has a molecular weight of 141.21 g/mol, XLogP of 2.02, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-4-methoxy-N-methylhex-3-en-2-imine is sourced from PubChem (CID 123311460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).