(Z)-1-cyclohexyl-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]ethanimine

C14H26N2O — CID 134894830

IUPAC(Z)-1-cyclohexyl-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]ethanimine
SMILESCOC[C@@H]1CCCN1/N=C(/C)C1CCCCC1
InChIInChI=1S/C14H26N2O/c1-12(13-7-4-3-5-8-13)15-16-10-6-9-14(16)11-17-2/h13-14H,3-11H2,1-2H3/b15-12-/t14-/m0/s1
InChIKeyZTXADJSPEZKUDD-UZFBZYOGSA-N
MW238.37 g/mol
LogP3.05
Rot. Bonds4

About (Z)-1-cyclohexyl-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]ethanimine

(Z)-1-cyclohexyl-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]ethanimine (PubChem CID 134894830) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is (Z)-1-cyclohexyl-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]ethanimine.

Molecular Properties

Compound Name(Z)-1-cyclohexyl-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]ethanimine
PubChem CID134894830
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name(Z)-1-cyclohexyl-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]ethanimine
SMILESCOC[C@@H]1CCCN1/N=C(/C)C1CCCCC1
InChIInChI=1S/C14H26N2O/c1-12(13-7-4-3-5-8-13)15-16-10-6-9-14(16)11-17-2/h13-14H,3-11H2,1-2H3/b15-12-/t14-/m0/s1
InChIKeyZTXADJSPEZKUDD-UZFBZYOGSA-N
XLogP3.05
TPSA24.83 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-1-cyclohexyl-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]ethanimine?
The IUPAC name of (Z)-1-cyclohexyl-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]ethanimine (CID 134894830) is (Z)-1-cyclohexyl-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]ethanimine.
What is the SMILES notation for (Z)-1-cyclohexyl-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]ethanimine?
The canonical SMILES for (Z)-1-cyclohexyl-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]ethanimine is COC[C@@H]1CCCN1/N=C(/C)C1CCCCC1.
What is the InChIKey of (Z)-1-cyclohexyl-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]ethanimine?
The InChIKey is ZTXADJSPEZKUDD-UZFBZYOGSA-N. The full InChI is InChI=1S/C14H26N2O/c1-12(13-7-4-3-5-8-13)15-16-10-6-9-14(16)11-17-2/h13-14H,3-11H2,1-2H3/b15-12-/t14-/m0/s1.
What are the key properties of (Z)-1-cyclohexyl-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]ethanimine?
(Z)-1-cyclohexyl-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]ethanimine has a molecular weight of 238.37 g/mol, XLogP of 3.05, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-cyclohexyl-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]ethanimine is sourced from PubChem (CID 134894830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).