(2,5-dimethylmorpholin-4-yl)-piperidin-3-ylmethanone;hydrochloride

C12H23ClN2O2 — CID 119292459

IUPAC(2,5-dimethylmorpholin-4-yl)-piperidin-3-ylmethanone;hydrochloride
SMILESCC1CN(C(=O)C2CCCNC2)C(C)CO1.Cl
InChIInChI=1S/C12H22N2O2.ClH/c1-9-8-16-10(2)7-14(9)12(15)11-4-3-5-13-6-11;/h9-11,13H,3-8H2,1-2H3;1H
InChIKeyMRDTTXJDOAVKGB-UHFFFAOYSA-N
MW262.78 g/mol
LogP1.04
Rot. Bonds1

About (2,5-dimethylmorpholin-4-yl)-piperidin-3-ylmethanone;hydrochloride

(2,5-dimethylmorpholin-4-yl)-piperidin-3-ylmethanone;hydrochloride (PubChem CID 119292459) has the molecular formula C12H23ClN2O2 and a molecular weight of 262.78 g/mol. Its IUPAC name is (2,5-dimethylmorpholin-4-yl)-piperidin-3-ylmethanone;hydrochloride.

Molecular Properties

Compound Name(2,5-dimethylmorpholin-4-yl)-piperidin-3-ylmethanone;hydrochloride
PubChem CID119292459
Molecular FormulaC12H23ClN2O2
Molecular Weight262.78 g/mol
Exact Mass262.14
IUPAC Name(2,5-dimethylmorpholin-4-yl)-piperidin-3-ylmethanone;hydrochloride
SMILESCC1CN(C(=O)C2CCCNC2)C(C)CO1.Cl
InChIInChI=1S/C12H22N2O2.ClH/c1-9-8-16-10(2)7-14(9)12(15)11-4-3-5-13-6-11;/h9-11,13H,3-8H2,1-2H3;1H
InChIKeyMRDTTXJDOAVKGB-UHFFFAOYSA-N
XLogP1.04
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.78
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(hydroxymethyl)-5-methylmorpholin-4-yl]-[(3S)-piperidin-3-yl]methanone
CID 81203650
cyclobutyl-(2,5-dimethylmorpholin-4-yl)methanone
CID 110727653
(5-ethyl-2-methylmorpholin-4-yl)-pyrrolidin-3-ylmethanone;hydrochloride
CID 119682273
(2,5-dimethylmorpholin-4-yl)-[(2R)-pyrrolidin-2-yl]methanone
CID 103795429
[(2R,5S)-5-methyl-2-(2-methylphenyl)morpholin-4-yl]-[(3S)-piperidin-3-yl]methanone
CID 124778318
1-(2,5-dimethylmorpholin-4-yl)-2-methyl-2-piperidin-3-ylpropan-1-one
CID 83199879
(2,5-dimethylmorpholin-4-yl)-piperazin-2-ylmethanone
CID 63103811
[(1R,3S)-3-aminocyclohexyl]-[(2R,5R)-2,5-dimethylmorpholin-4-yl]methanone
CID 94594163
(2-methylpiperidin-1-yl)-[(3R)-piperidin-3-yl]methanone
CID 81123466
(2,6-dimethylpiperidin-1-yl)-piperidin-3-ylmethanone
CID 18072139
(2-methyl-1,4-oxazepan-4-yl)-[(3S)-piperidin-3-yl]methanone
CID 81141316
(2,6-dimethylmorpholin-4-yl)-[(3S)-piperidin-3-yl]methanone
CID 81123196

Frequently Asked Questions

What is the IUPAC name of (2,5-dimethylmorpholin-4-yl)-piperidin-3-ylmethanone;hydrochloride?
The IUPAC name of (2,5-dimethylmorpholin-4-yl)-piperidin-3-ylmethanone;hydrochloride (CID 119292459) is (2,5-dimethylmorpholin-4-yl)-piperidin-3-ylmethanone;hydrochloride.
What is the SMILES notation for (2,5-dimethylmorpholin-4-yl)-piperidin-3-ylmethanone;hydrochloride?
The canonical SMILES for (2,5-dimethylmorpholin-4-yl)-piperidin-3-ylmethanone;hydrochloride is CC1CN(C(=O)C2CCCNC2)C(C)CO1.Cl.
What is the InChIKey of (2,5-dimethylmorpholin-4-yl)-piperidin-3-ylmethanone;hydrochloride?
The InChIKey is MRDTTXJDOAVKGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2.ClH/c1-9-8-16-10(2)7-14(9)12(15)11-4-3-5-13-6-11;/h9-11,13H,3-8H2,1-2H3;1H.
What are the key properties of (2,5-dimethylmorpholin-4-yl)-piperidin-3-ylmethanone;hydrochloride?
(2,5-dimethylmorpholin-4-yl)-piperidin-3-ylmethanone;hydrochloride has a molecular weight of 262.78 g/mol, XLogP of 1.04, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dimethylmorpholin-4-yl)-piperidin-3-ylmethanone;hydrochloride is sourced from PubChem (CID 119292459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).