(Z)-5-methoxyhex-3-en-2-imine

C7H13NO — CID 123705474

IUPAC(Z)-5-methoxyhex-3-en-2-imine
SMILES[H]/N=C(C)/C=C\C(C)OC
InChIInChI=1S/C7H13NO/c1-6(8)4-5-7(2)9-3/h4-5,7-8H,1-3H3/b5-4-,8-6+
InChIKeyWEXYBXNUUMSENT-GSGSLZOQSA-N
MW127.19 g/mol
LogP1.62
Rot. Bonds3

About (Z)-5-methoxyhex-3-en-2-imine

(Z)-5-methoxyhex-3-en-2-imine (PubChem CID 123705474) has the molecular formula C7H13NO and a molecular weight of 127.19 g/mol. Its IUPAC name is (Z)-5-methoxyhex-3-en-2-imine.

Molecular Properties

Compound Name(Z)-5-methoxyhex-3-en-2-imine
PubChem CID123705474
Molecular FormulaC7H13NO
Molecular Weight127.19 g/mol
Exact Mass127.10
IUPAC Name(Z)-5-methoxyhex-3-en-2-imine
SMILES[H]/N=C(C)/C=C\C(C)OC
InChIInChI=1S/C7H13NO/c1-6(8)4-5-7(2)9-3/h4-5,7-8H,1-3H3/b5-4-,8-6+
InChIKeyWEXYBXNUUMSENT-GSGSLZOQSA-N
XLogP1.62
TPSA33.08 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.19
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

(2Z,4Z)-3-ethyl-6-methoxyhepta-2,4-diene
CID 143089763
(Z)-4-(imino-λ3-iodanyl)but-3-en-2-imine
CID 146788075
(4Z)-2,6-dimethylhepta-1,4-dien-3-imine
CID 123954860
4-methoxy-3-methylpentan-2-imine
CID 174533690
(2E,4Z)-6-methoxy-N-(trifluoromethyl)hepta-2,4-dien-3-amine
CID 155470395
(Z)-4-N-propan-2-ylidenebut-3-ene-2,4-diimine
CID 130413517
(Z)-4-iminopent-2-en-1-amine
CID 142289238
(3Z,5E)-5-bromohepta-3,5-dien-2-imine
CID 156548743
(Z)-8-imino-3-methylnon-6-en-1-ol
CID 134553932
(Z,5E)-5-ethylidenehept-3-ene-2,6-diimine
CID 123707511
(Z)-hept-3-ene-2,5-diimine
CID 143456495
(Z)-4-imino-N-methylpent-2-en-1-amine
CID 145282389

Frequently Asked Questions

What is the IUPAC name of (Z)-5-methoxyhex-3-en-2-imine?
The IUPAC name of (Z)-5-methoxyhex-3-en-2-imine (CID 123705474) is (Z)-5-methoxyhex-3-en-2-imine.
What is the SMILES notation for (Z)-5-methoxyhex-3-en-2-imine?
The canonical SMILES for (Z)-5-methoxyhex-3-en-2-imine is [H]/N=C(C)/C=C\C(C)OC.
What is the InChIKey of (Z)-5-methoxyhex-3-en-2-imine?
The InChIKey is WEXYBXNUUMSENT-GSGSLZOQSA-N. The full InChI is InChI=1S/C7H13NO/c1-6(8)4-5-7(2)9-3/h4-5,7-8H,1-3H3/b5-4-,8-6+.
What are the key properties of (Z)-5-methoxyhex-3-en-2-imine?
(Z)-5-methoxyhex-3-en-2-imine has a molecular weight of 127.19 g/mol, XLogP of 1.62, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-5-methoxyhex-3-en-2-imine is sourced from PubChem (CID 123705474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).