ethane;4-(methoxymethyl)-1-(piperidin-4-ylmethyl)piperidine

C15H32N2O — CID 144757867

IUPACethane;4-(methoxymethyl)-1-(piperidin-4-ylmethyl)piperidine
SMILESCC.COCC1CCN(CC2CCNCC2)CC1
InChIInChI=1S/C13H26N2O.C2H6/c1-16-11-13-4-8-15(9-5-13)10-12-2-6-14-7-3-12;1-2/h12-14H,2-11H2,1H3;1-2H3
InChIKeyZESBSSDDRDCIQX-UHFFFAOYSA-N
MW256.43 g/mol
LogP2.37
Rot. Bonds4

About ethane;4-(methoxymethyl)-1-(piperidin-4-ylmethyl)piperidine

ethane;4-(methoxymethyl)-1-(piperidin-4-ylmethyl)piperidine (PubChem CID 144757867) has the molecular formula C15H32N2O and a molecular weight of 256.43 g/mol. Its IUPAC name is ethane;4-(methoxymethyl)-1-(piperidin-4-ylmethyl)piperidine.

Molecular Properties

Compound Nameethane;4-(methoxymethyl)-1-(piperidin-4-ylmethyl)piperidine
PubChem CID144757867
Molecular FormulaC15H32N2O
Molecular Weight256.43 g/mol
Exact Mass256.25
IUPAC Nameethane;4-(methoxymethyl)-1-(piperidin-4-ylmethyl)piperidine
SMILESCC.COCC1CCN(CC2CCNCC2)CC1
InChIInChI=1S/C13H26N2O.C2H6/c1-16-11-13-4-8-15(9-5-13)10-12-2-6-14-7-3-12;1-2/h12-14H,2-11H2,1H3;1-2H3
InChIKeyZESBSSDDRDCIQX-UHFFFAOYSA-N
XLogP2.37
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.43
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(methoxymethyl)-1-[(1-methylpiperidin-4-yl)methyl]piperidine
CID 121451427
N-methyl-1-[1-(piperidin-4-ylmethyl)piperidin-4-yl]methanamine
CID 156720132
1,4-bis(piperidin-4-ylmethyl)piperazine
CID 18770387
[1-(piperidin-4-ylmethyl)piperidin-4-yl]methyl carbamate
CID 175359661
1,4-bis(piperidin-4-ylmethyl)piperazine;tetrahydrochloride
CID 18770386
4-(methoxymethyl)-1-(pyrrolidin-2-ylmethyl)piperidine
CID 63971924
4-(methoxymethyl)-1-(oxiran-2-ylmethyl)piperidine
CID 63972885
1-ethyl-4-[(4-piperidin-4-ylpiperidin-1-yl)methyl]piperidine
CID 167091278
ethane;4-ethyl-1-(pyrrolidin-3-ylmethyl)piperidine
CID 166478727
2-[[4-(methoxymethyl)piperidin-1-yl]methyl]-3-methylpiperidine
CID 107069292
4-(3-methylbutyl)-1-(piperidin-4-ylmethyl)piperidine;hydrochloride
CID 119932466
4-[(3,4-dimethoxypyrrolidin-1-yl)methyl]piperidine
CID 103533927

Frequently Asked Questions

What is the IUPAC name of ethane;4-(methoxymethyl)-1-(piperidin-4-ylmethyl)piperidine?
The IUPAC name of ethane;4-(methoxymethyl)-1-(piperidin-4-ylmethyl)piperidine (CID 144757867) is ethane;4-(methoxymethyl)-1-(piperidin-4-ylmethyl)piperidine.
What is the SMILES notation for ethane;4-(methoxymethyl)-1-(piperidin-4-ylmethyl)piperidine?
The canonical SMILES for ethane;4-(methoxymethyl)-1-(piperidin-4-ylmethyl)piperidine is CC.COCC1CCN(CC2CCNCC2)CC1.
What is the InChIKey of ethane;4-(methoxymethyl)-1-(piperidin-4-ylmethyl)piperidine?
The InChIKey is ZESBSSDDRDCIQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O.C2H6/c1-16-11-13-4-8-15(9-5-13)10-12-2-6-14-7-3-12;1-2/h12-14H,2-11H2,1H3;1-2H3.
What are the key properties of ethane;4-(methoxymethyl)-1-(piperidin-4-ylmethyl)piperidine?
ethane;4-(methoxymethyl)-1-(piperidin-4-ylmethyl)piperidine has a molecular weight of 256.43 g/mol, XLogP of 2.37, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-(methoxymethyl)-1-(piperidin-4-ylmethyl)piperidine is sourced from PubChem (CID 144757867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).