1-(4-methoxy-2-methylpiperidin-1-yl)ethanimine

C9H18N2O — CID 130485928

IUPAC1-(4-methoxy-2-methylpiperidin-1-yl)ethanimine
SMILES[H]/N=C(\C)N1CCC(OC)CC1C
InChIInChI=1S/C9H18N2O/c1-7-6-9(12-3)4-5-11(7)8(2)10/h7,9-10H,4-6H2,1-3H3/b10-8+
InChIKeyKAUQNGFJHPSMDH-CSKARUKUSA-N
MW170.26 g/mol
LogP1.48
Rot. Bonds1

About 1-(4-methoxy-2-methylpiperidin-1-yl)ethanimine

1-(4-methoxy-2-methylpiperidin-1-yl)ethanimine (PubChem CID 130485928) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is 1-(4-methoxy-2-methylpiperidin-1-yl)ethanimine.

Molecular Properties

Compound Name1-(4-methoxy-2-methylpiperidin-1-yl)ethanimine
PubChem CID130485928
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC Name1-(4-methoxy-2-methylpiperidin-1-yl)ethanimine
SMILES[H]/N=C(\C)N1CCC(OC)CC1C
InChIInChI=1S/C9H18N2O/c1-7-6-9(12-3)4-5-11(7)8(2)10/h7,9-10H,4-6H2,1-3H3/b10-8+
InChIKeyKAUQNGFJHPSMDH-CSKARUKUSA-N
XLogP1.48
TPSA36.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

1-(4-Methoxypiperidin-1-yl)ethanimine
CID 18727529
1-[4-[(2-Methylpropan-2-yl)oxy]piperidin-1-yl]ethanimine
CID 20765497
1-[4-(Propan-2-yloxy)piperidin-1-yl]ethan-1-imine
CID 117882710
Methane;1-(4-methoxypiperidin-1-yl)ethanimine
CID 159843772
Hexane;1-methanimidoyl-4-methoxypiperidin-2-imine
CID 168894284
4-(4-Ethoxy-2-iminopiperidin-1-yl)butan-1-amine
CID 174831682
1-Ethanimidoyl-2,6-dimethylpiperidin-4-ol
CID 177033685
3-(4-Methoxypiperidin-1-yl)pentanimidamide
CID 43372991
4-(4-Methoxypiperidin-1-yl)butanimidamide
CID 43372995
3-(4-Methoxypiperidin-1-yl)butanimidamide
CID 60913510
3-(4-Ethoxypiperidin-1-yl)pentanimidamide
CID 61219382
3-(4-Ethoxypiperidin-1-yl)butanimidamide
CID 61219384

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxy-2-methylpiperidin-1-yl)ethanimine?
The IUPAC name of 1-(4-methoxy-2-methylpiperidin-1-yl)ethanimine (CID 130485928) is 1-(4-methoxy-2-methylpiperidin-1-yl)ethanimine.
What is the SMILES notation for 1-(4-methoxy-2-methylpiperidin-1-yl)ethanimine?
The canonical SMILES for 1-(4-methoxy-2-methylpiperidin-1-yl)ethanimine is [H]/N=C(\C)N1CCC(OC)CC1C.
What is the InChIKey of 1-(4-methoxy-2-methylpiperidin-1-yl)ethanimine?
The InChIKey is KAUQNGFJHPSMDH-CSKARUKUSA-N. The full InChI is InChI=1S/C9H18N2O/c1-7-6-9(12-3)4-5-11(7)8(2)10/h7,9-10H,4-6H2,1-3H3/b10-8+.
What are the key properties of 1-(4-methoxy-2-methylpiperidin-1-yl)ethanimine?
1-(4-methoxy-2-methylpiperidin-1-yl)ethanimine has a molecular weight of 170.26 g/mol, XLogP of 1.48, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxy-2-methylpiperidin-1-yl)ethanimine is sourced from PubChem (CID 130485928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).