3-ethyl-3-methyl-4-(piperidin-3-ylmethyl)morpholine;hydrochloride

C13H27ClN2O — CID 120849148

IUPAC3-ethyl-3-methyl-4-(piperidin-3-ylmethyl)morpholine;hydrochloride
SMILESCCC1(C)COCCN1CC1CCCNC1.Cl
InChIInChI=1S/C13H26N2O.ClH/c1-3-13(2)11-16-8-7-15(13)10-12-5-4-6-14-9-12;/h12,14H,3-11H2,1-2H3;1H
InChIKeyBGSWZTSWMXETNB-UHFFFAOYSA-N
MW262.82 g/mol
LogP1.91
Rot. Bonds3

About 3-ethyl-3-methyl-4-(piperidin-3-ylmethyl)morpholine;hydrochloride

3-ethyl-3-methyl-4-(piperidin-3-ylmethyl)morpholine;hydrochloride (PubChem CID 120849148) has the molecular formula C13H27ClN2O and a molecular weight of 262.82 g/mol. Its IUPAC name is 3-ethyl-3-methyl-4-(piperidin-3-ylmethyl)morpholine;hydrochloride.

Molecular Properties

Compound Name3-ethyl-3-methyl-4-(piperidin-3-ylmethyl)morpholine;hydrochloride
PubChem CID120849148
Molecular FormulaC13H27ClN2O
Molecular Weight262.82 g/mol
Exact Mass262.18
IUPAC Name3-ethyl-3-methyl-4-(piperidin-3-ylmethyl)morpholine;hydrochloride
SMILESCCC1(C)COCCN1CC1CCCNC1.Cl
InChIInChI=1S/C13H26N2O.ClH/c1-3-13(2)11-16-8-7-15(13)10-12-5-4-6-14-9-12;/h12,14H,3-11H2,1-2H3;1H
InChIKeyBGSWZTSWMXETNB-UHFFFAOYSA-N
XLogP1.91
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.82
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(piperidin-3-ylmethyl)-2,9-dioxa-6-azaspiro[4.5]decane
CID 120855430
1-(cyclopentylmethyl)-2-ethyl-2-methylpiperazine
CID 64832354
9-(piperidin-3-ylmethyl)-6-oxa-9-azaspiro[3.6]decane
CID 120856412
4-(cyclobutylmethyl)-3,3-dimethylmorpholine
CID 127377423
5-(piperidin-3-ylmethyl)-5-azaspiro[3.4]octane;hydrochloride
CID 120858012
(3S)-3-[(3-ethyl-3-methylazetidin-1-yl)methyl]piperidine
CID 131186194
3-methyl-4-(piperidin-3-ylmethyl)morpholine
CID 43542278
[2-ethyl-1-(piperidin-3-ylmethyl)pyrrolidin-2-yl]methanol
CID 120848962
3-[[2-(oxan-4-yl)pyrrolidin-1-yl]methyl]piperidine;hydrochloride
CID 120855567
3-[(3,3-dimethylazetidin-1-yl)methyl]piperidine
CID 79678705
2-tert-butyl-4-(piperidin-3-ylmethyl)morpholine
CID 120858117
4-(dimethoxymethyl)-1-(piperidin-3-ylmethyl)piperidine
CID 174255823

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-3-methyl-4-(piperidin-3-ylmethyl)morpholine;hydrochloride?
The IUPAC name of 3-ethyl-3-methyl-4-(piperidin-3-ylmethyl)morpholine;hydrochloride (CID 120849148) is 3-ethyl-3-methyl-4-(piperidin-3-ylmethyl)morpholine;hydrochloride.
What is the SMILES notation for 3-ethyl-3-methyl-4-(piperidin-3-ylmethyl)morpholine;hydrochloride?
The canonical SMILES for 3-ethyl-3-methyl-4-(piperidin-3-ylmethyl)morpholine;hydrochloride is CCC1(C)COCCN1CC1CCCNC1.Cl.
What is the InChIKey of 3-ethyl-3-methyl-4-(piperidin-3-ylmethyl)morpholine;hydrochloride?
The InChIKey is BGSWZTSWMXETNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O.ClH/c1-3-13(2)11-16-8-7-15(13)10-12-5-4-6-14-9-12;/h12,14H,3-11H2,1-2H3;1H.
What are the key properties of 3-ethyl-3-methyl-4-(piperidin-3-ylmethyl)morpholine;hydrochloride?
3-ethyl-3-methyl-4-(piperidin-3-ylmethyl)morpholine;hydrochloride has a molecular weight of 262.82 g/mol, XLogP of 1.91, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-3-methyl-4-(piperidin-3-ylmethyl)morpholine;hydrochloride is sourced from PubChem (CID 120849148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).