N-(6-methoxyhexyl)methanimine

C8H17NO — CID 20714851

IUPACN-(6-methoxyhexyl)methanimine
SMILESC=NCCCCCCOC
InChIInChI=1S/C8H17NO/c1-9-7-5-3-4-6-8-10-2/h1,3-8H2,2H3
InChIKeyJXCHWONELXUGME-UHFFFAOYSA-N
MW143.23 g/mol
LogP1.89
Rot. Bonds7

About N-(6-methoxyhexyl)methanimine

N-(6-methoxyhexyl)methanimine (PubChem CID 20714851) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is N-(6-methoxyhexyl)methanimine.

Molecular Properties

Compound NameN-(6-methoxyhexyl)methanimine
PubChem CID20714851
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC NameN-(6-methoxyhexyl)methanimine
SMILESC=NCCCCCCOC
InChIInChI=1S/C8H17NO/c1-9-7-5-3-4-6-8-10-2/h1,3-8H2,2H3
InChIKeyJXCHWONELXUGME-UHFFFAOYSA-N
XLogP1.89
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 51.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(6-methoxyhexyl)methanimine?
The IUPAC name of N-(6-methoxyhexyl)methanimine (CID 20714851) is N-(6-methoxyhexyl)methanimine.
What is the SMILES notation for N-(6-methoxyhexyl)methanimine?
The canonical SMILES for N-(6-methoxyhexyl)methanimine is C=NCCCCCCOC.
What is the InChIKey of N-(6-methoxyhexyl)methanimine?
The InChIKey is JXCHWONELXUGME-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-9-7-5-3-4-6-8-10-2/h1,3-8H2,2H3.
What are the key properties of N-(6-methoxyhexyl)methanimine?
N-(6-methoxyhexyl)methanimine has a molecular weight of 143.23 g/mol, XLogP of 1.89, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methoxyhexyl)methanimine is sourced from PubChem (CID 20714851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).