2-(2,2-dimethylmorpholin-4-yl)-1-piperidin-1-ylethanone

C13H24N2O2 — CID 70907050

IUPAC2-(2,2-dimethylmorpholin-4-yl)-1-piperidin-1-ylethanone
SMILESCC1(C)CN(CC(=O)N2CCCCC2)CCO1
InChIInChI=1S/C13H24N2O2/c1-13(2)11-14(8-9-17-13)10-12(16)15-6-4-3-5-7-15/h3-11H2,1-2H3
InChIKeyHWBJHZVCQKDLSA-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.11
Rot. Bonds2

About 2-(2,2-dimethylmorpholin-4-yl)-1-piperidin-1-ylethanone

2-(2,2-dimethylmorpholin-4-yl)-1-piperidin-1-ylethanone (PubChem CID 70907050) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 2-(2,2-dimethylmorpholin-4-yl)-1-piperidin-1-ylethanone.

Molecular Properties

Compound Name2-(2,2-dimethylmorpholin-4-yl)-1-piperidin-1-ylethanone
PubChem CID70907050
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name2-(2,2-dimethylmorpholin-4-yl)-1-piperidin-1-ylethanone
SMILESCC1(C)CN(CC(=O)N2CCCCC2)CCO1
InChIInChI=1S/C13H24N2O2/c1-13(2)11-14(8-9-17-13)10-12(16)15-6-4-3-5-7-15/h3-11H2,1-2H3
InChIKeyHWBJHZVCQKDLSA-UHFFFAOYSA-N
XLogP1.11
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-N,2-dimethyl-4-(2-oxo-2-piperidin-1-ylethyl)morpholine-2-carboxamide
CID 124976279
2-(2,2-dimethyl-1,4-oxazepan-4-yl)acetamide
CID 130684724
1-(azocan-1-yl)-2-(3-hydroxy-3-methylpiperidin-1-yl)ethanone
CID 115873988
2-(1,4-dioxa-7-azaspiro[4.4]nonan-7-yl)-1-pyrrolidin-1-ylethanone
CID 131182071
ethyl 4-(2,2-dimethylmorpholin-4-yl)-3-oxobutanoate
CID 63898681
methyl 1-[2-(2,2-dimethylmorpholin-4-yl)acetyl]aziridine-2-carboxylate
CID 89049260
2-(4-acetylpiperazin-1-yl)-1-pyrrolidin-1-ylethanone
CID 14226088
2-[(5S,6S)-6-methoxy-1-oxa-9-azaspiro[4.5]decan-9-yl]-1-pyrrolidin-1-ylethanone
CID 110159396
(3S)-6,6-dimethyl-4-(2-oxo-2-pyrrolidin-1-ylethyl)morpholine-3-carboxylic acid
CID 68523362
3-methyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)piperidine-3-carbonitrile
CID 131945394
2-(azetidin-1-yl)-1-pyrrolidin-1-ylethanone
CID 130618835
1-(azetidin-1-yl)-2-pyrrolidin-1-ylethanone
CID 91265703

Frequently Asked Questions

What is the IUPAC name of 2-(2,2-dimethylmorpholin-4-yl)-1-piperidin-1-ylethanone?
The IUPAC name of 2-(2,2-dimethylmorpholin-4-yl)-1-piperidin-1-ylethanone (CID 70907050) is 2-(2,2-dimethylmorpholin-4-yl)-1-piperidin-1-ylethanone.
What is the SMILES notation for 2-(2,2-dimethylmorpholin-4-yl)-1-piperidin-1-ylethanone?
The canonical SMILES for 2-(2,2-dimethylmorpholin-4-yl)-1-piperidin-1-ylethanone is CC1(C)CN(CC(=O)N2CCCCC2)CCO1.
What is the InChIKey of 2-(2,2-dimethylmorpholin-4-yl)-1-piperidin-1-ylethanone?
The InChIKey is HWBJHZVCQKDLSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-13(2)11-14(8-9-17-13)10-12(16)15-6-4-3-5-7-15/h3-11H2,1-2H3.
What are the key properties of 2-(2,2-dimethylmorpholin-4-yl)-1-piperidin-1-ylethanone?
2-(2,2-dimethylmorpholin-4-yl)-1-piperidin-1-ylethanone has a molecular weight of 240.35 g/mol, XLogP of 1.11, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-dimethylmorpholin-4-yl)-1-piperidin-1-ylethanone is sourced from PubChem (CID 70907050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).