cyclopentyl-(4-methoxypiperidin-1-yl)methanimine

C12H22N2O — CID 63175586

IUPACcyclopentyl-(4-methoxypiperidin-1-yl)methanimine
SMILES[H]/N=C(\C1CCCC1)N1CCC(OC)CC1
InChIInChI=1S/C12H22N2O/c1-15-11-6-8-14(9-7-11)12(13)10-4-2-3-5-10/h10-11,13H,2-9H2,1H3/b13-12+
InChIKeyRFRKADHSZQYSBN-OUKQBFOZSA-N
MW210.32 g/mol
LogP2.26
Rot. Bonds2

About cyclopentyl-(4-methoxypiperidin-1-yl)methanimine

cyclopentyl-(4-methoxypiperidin-1-yl)methanimine (PubChem CID 63175586) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is cyclopentyl-(4-methoxypiperidin-1-yl)methanimine.

Molecular Properties

Compound Namecyclopentyl-(4-methoxypiperidin-1-yl)methanimine
PubChem CID63175586
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC Namecyclopentyl-(4-methoxypiperidin-1-yl)methanimine
SMILES[H]/N=C(\C1CCCC1)N1CCC(OC)CC1
InChIInChI=1S/C12H22N2O/c1-15-11-6-8-14(9-7-11)12(13)10-4-2-3-5-10/h10-11,13H,2-9H2,1H3/b13-12+
InChIKeyRFRKADHSZQYSBN-OUKQBFOZSA-N
XLogP2.26
TPSA36.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 52.26
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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Frequently Asked Questions

What is the IUPAC name of cyclopentyl-(4-methoxypiperidin-1-yl)methanimine?
The IUPAC name of cyclopentyl-(4-methoxypiperidin-1-yl)methanimine (CID 63175586) is cyclopentyl-(4-methoxypiperidin-1-yl)methanimine.
What is the SMILES notation for cyclopentyl-(4-methoxypiperidin-1-yl)methanimine?
The canonical SMILES for cyclopentyl-(4-methoxypiperidin-1-yl)methanimine is [H]/N=C(\C1CCCC1)N1CCC(OC)CC1.
What is the InChIKey of cyclopentyl-(4-methoxypiperidin-1-yl)methanimine?
The InChIKey is RFRKADHSZQYSBN-OUKQBFOZSA-N. The full InChI is InChI=1S/C12H22N2O/c1-15-11-6-8-14(9-7-11)12(13)10-4-2-3-5-10/h10-11,13H,2-9H2,1H3/b13-12+.
What are the key properties of cyclopentyl-(4-methoxypiperidin-1-yl)methanimine?
cyclopentyl-(4-methoxypiperidin-1-yl)methanimine has a molecular weight of 210.32 g/mol, XLogP of 2.26, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl-(4-methoxypiperidin-1-yl)methanimine is sourced from PubChem (CID 63175586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).