1-[4-(2,3-dimethylmorpholine-4-carbonyl)piperidin-1-yl]ethanone

C14H24N2O3 — CID 110744442

IUPAC1-[4-(2,3-dimethylmorpholine-4-carbonyl)piperidin-1-yl]ethanone
SMILESCC(=O)N1CCC(C(=O)N2CCOC(C)C2C)CC1
InChIInChI=1S/C14H24N2O3/c1-10-11(2)19-9-8-16(10)14(18)13-4-6-15(7-5-13)12(3)17/h10-11,13H,4-9H2,1-3H3
InChIKeyMLNSBRKGCCPLEW-UHFFFAOYSA-N
MW268.36 g/mol
LogP0.88
Rot. Bonds1

About 1-[4-(2,3-dimethylmorpholine-4-carbonyl)piperidin-1-yl]ethanone

1-[4-(2,3-dimethylmorpholine-4-carbonyl)piperidin-1-yl]ethanone (PubChem CID 110744442) has the molecular formula C14H24N2O3 and a molecular weight of 268.36 g/mol. Its IUPAC name is 1-[4-(2,3-dimethylmorpholine-4-carbonyl)piperidin-1-yl]ethanone.

Molecular Properties

Compound Name1-[4-(2,3-dimethylmorpholine-4-carbonyl)piperidin-1-yl]ethanone
PubChem CID110744442
Molecular FormulaC14H24N2O3
Molecular Weight268.36 g/mol
Exact Mass268.18
IUPAC Name1-[4-(2,3-dimethylmorpholine-4-carbonyl)piperidin-1-yl]ethanone
SMILESCC(=O)N1CCC(C(=O)N2CCOC(C)C2C)CC1
InChIInChI=1S/C14H24N2O3/c1-10-11(2)19-9-8-16(10)14(18)13-4-6-15(7-5-13)12(3)17/h10-11,13H,4-9H2,1-3H3
InChIKeyMLNSBRKGCCPLEW-UHFFFAOYSA-N
XLogP0.88
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 50.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-(2,4-dimethylpiperazine-1-carbonyl)piperidin-1-yl]ethanone
CID 110741134
2-bromo-1-(2,3-dimethylmorpholin-4-yl)-2-methylpropan-1-one
CID 130825771
1-[4-[1-(oxolane-2-carbonyl)piperidine-4-carbonyl]piperazin-1-yl]ethanone
CID 113003827
4-acetyl-2-methylmorpholine-3-carboxylic acid
CID 118137411
N-tert-butyl-2,3-dimethylmorpholine-4-carboxamide
CID 110748549
(2S)-4-(1-acetylpiperidine-4-carbonyl)-N,2-dimethylmorpholine-2-carboxamide
CID 95839624
N-[4-(2,3-dimethylmorpholine-4-carbonyl)phenyl]acetamide
CID 110744443
1-(1-acetylpiperidine-4-carbonyl)azepane-2-carboxylic acid
CID 64560305
1-[4-[4-(4-acetylpiperazine-1-carbonyl)cyclohexanecarbonyl]piperazin-1-yl]ethanone
CID 2375184
1-(2-methyloxolane-3-carbonyl)pyrrolidine-3-carboxylic acid
CID 79750690
1-(4,5-dimethylazepan-1-yl)ethanone
CID 139460502
1-[4-[4-(morpholine-4-carbonyl)cyclohexanecarbonyl]piperazin-1-yl]ethanone
CID 109146746

Frequently Asked Questions

What is the IUPAC name of 1-[4-(2,3-dimethylmorpholine-4-carbonyl)piperidin-1-yl]ethanone?
The IUPAC name of 1-[4-(2,3-dimethylmorpholine-4-carbonyl)piperidin-1-yl]ethanone (CID 110744442) is 1-[4-(2,3-dimethylmorpholine-4-carbonyl)piperidin-1-yl]ethanone.
What is the SMILES notation for 1-[4-(2,3-dimethylmorpholine-4-carbonyl)piperidin-1-yl]ethanone?
The canonical SMILES for 1-[4-(2,3-dimethylmorpholine-4-carbonyl)piperidin-1-yl]ethanone is CC(=O)N1CCC(C(=O)N2CCOC(C)C2C)CC1.
What is the InChIKey of 1-[4-(2,3-dimethylmorpholine-4-carbonyl)piperidin-1-yl]ethanone?
The InChIKey is MLNSBRKGCCPLEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3/c1-10-11(2)19-9-8-16(10)14(18)13-4-6-15(7-5-13)12(3)17/h10-11,13H,4-9H2,1-3H3.
What are the key properties of 1-[4-(2,3-dimethylmorpholine-4-carbonyl)piperidin-1-yl]ethanone?
1-[4-(2,3-dimethylmorpholine-4-carbonyl)piperidin-1-yl]ethanone has a molecular weight of 268.36 g/mol, XLogP of 0.88, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(2,3-dimethylmorpholine-4-carbonyl)piperidin-1-yl]ethanone is sourced from PubChem (CID 110744442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).