1-[4-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one

C13H22N2O3 — CID 110604424

IUPAC1-[4-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one
SMILESCCC(=O)N1CCC(C(=O)N2CCOCC2)CC1
InChIInChI=1S/C13H22N2O3/c1-2-12(16)14-5-3-11(4-6-14)13(17)15-7-9-18-10-8-15/h11H,2-10H2,1H3
InChIKeyURKROMFIEDGRMP-UHFFFAOYSA-N
MW254.33 g/mol
LogP0.49
Rot. Bonds2

About 1-[4-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one

1-[4-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one (PubChem CID 110604424) has the molecular formula C13H22N2O3 and a molecular weight of 254.33 g/mol. Its IUPAC name is 1-[4-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one.

Molecular Properties

Compound Name1-[4-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one
PubChem CID110604424
Molecular FormulaC13H22N2O3
Molecular Weight254.33 g/mol
Exact Mass254.16
IUPAC Name1-[4-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one
SMILESCCC(=O)N1CCC(C(=O)N2CCOCC2)CC1
InChIInChI=1S/C13H22N2O3/c1-2-12(16)14-5-3-11(4-6-14)13(17)15-7-9-18-10-8-15/h11H,2-10H2,1H3
InChIKeyURKROMFIEDGRMP-UHFFFAOYSA-N
XLogP0.49
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 50.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-(piperidine-1-carbonyl)piperidin-1-yl]propan-1-one
CID 113003020
1-[4-[4-(morpholine-4-carbonyl)piperidin-1-yl]piperidin-1-yl]butan-1-one
CID 42693440
1-[4-[4-(morpholine-4-carbonyl)cyclohexanecarbonyl]piperazin-1-yl]ethanone
CID 109146746
[1-(2-methylpropyl)piperidin-4-yl]-morpholin-4-ylmethanone
CID 883920
4-(1-propanoylpiperidine-4-carbonyl)piperazine-1-carbaldehyde
CID 113003741
cyclopropyl-[4-(morpholine-4-carbonyl)piperazin-1-yl]methanone
CID 110346881
1-[4-(cyclobutanecarbonyl)-1,4-diazepan-1-yl]propan-1-one
CID 110796478
1-[4-(morpholin-4-ylmethyl)piperidin-1-yl]propan-1-one
CID 60773954
1-[4-[4-(ethoxymethyl)piperidine-1-carbonyl]piperidin-1-yl]propan-1-one
CID 131909918
(1-tert-butylpiperidin-4-yl)-morpholin-4-ylmethanone
CID 21061611
[1-(oxane-4-carbonyl)piperidin-4-yl]-(4-propan-2-ylpiperidin-1-yl)methanone
CID 155764611
2-(4-ethoxyphenyl)-1-[4-(morpholine-4-carbonyl)piperidin-1-yl]ethanone
CID 110428417

Frequently Asked Questions

What is the IUPAC name of 1-[4-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one?
The IUPAC name of 1-[4-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one (CID 110604424) is 1-[4-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one.
What is the SMILES notation for 1-[4-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one?
The canonical SMILES for 1-[4-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one is CCC(=O)N1CCC(C(=O)N2CCOCC2)CC1.
What is the InChIKey of 1-[4-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one?
The InChIKey is URKROMFIEDGRMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O3/c1-2-12(16)14-5-3-11(4-6-14)13(17)15-7-9-18-10-8-15/h11H,2-10H2,1H3.
What are the key properties of 1-[4-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one?
1-[4-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one has a molecular weight of 254.33 g/mol, XLogP of 0.49, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one is sourced from PubChem (CID 110604424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).