2-methyl-1,2-dimorpholin-4-ylpropan-1-one

C12H22N2O3 — CID 12595675

IUPAC2-methyl-1,2-dimorpholin-4-ylpropan-1-one
SMILESCC(C)(C(=O)N1CCOCC1)N1CCOCC1
InChIInChI=1S/C12H22N2O3/c1-12(2,14-5-9-17-10-6-14)11(15)13-3-7-16-8-4-13/h3-10H2,1-2H3
InChIKeyCSGPRCMYAZMHKK-UHFFFAOYSA-N
MW242.32 g/mol
LogP-0.04
Rot. Bonds2

About 2-methyl-1,2-dimorpholin-4-ylpropan-1-one

2-methyl-1,2-dimorpholin-4-ylpropan-1-one (PubChem CID 12595675) has the molecular formula C12H22N2O3 and a molecular weight of 242.32 g/mol. Its IUPAC name is 2-methyl-1,2-dimorpholin-4-ylpropan-1-one.

Molecular Properties

Compound Name2-methyl-1,2-dimorpholin-4-ylpropan-1-one
PubChem CID12595675
Molecular FormulaC12H22N2O3
Molecular Weight242.32 g/mol
Exact Mass242.16
IUPAC Name2-methyl-1,2-dimorpholin-4-ylpropan-1-one
SMILESCC(C)(C(=O)N1CCOCC1)N1CCOCC1
InChIInChI=1S/C12H22N2O3/c1-12(2,14-5-9-17-10-6-14)11(15)13-3-7-16-8-4-13/h3-10H2,1-2H3
InChIKeyCSGPRCMYAZMHKK-UHFFFAOYSA-N
XLogP-0.04
TPSA42.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 5-0.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-methyl-1,2-dimorpholin-4-ylpropan-1-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1,2-Ethanedione, 1,2-di-4-morpholinyl-
CID 240445
1,2-Dimorpholinoethanone
CID 242924
4-(2-Methoxyethyl)-6,6-dimethyl-1-propan-2-ylpiperazin-2-one
CID 75374977
1-[4-(2-Methylpropyl)piperazin-1-yl]-2-morpholin-4-ylethanone
CID 45803767
1-(Morpholin-4-yl)-2-(piperazin-1-yl)propan-1-one
CID 16769381
2-(2,5-Dimethylmorpholin-4-yl)-1-(2-methylmorpholin-4-yl)ethanone
CID 45811018
2-(2,6-Dimethylmorpholin-4-yl)-3-methyl-1-(2-methylmorpholin-4-yl)butan-1-one
CID 56799483
3,3-dimethyl-4-[2-[(3S)-3-methylmorpholin-4-yl]ethyl]-1-propylpiperazin-2-one
CID 99837364
(2S)-2-[4-(2-methoxyethyl)-3-oxopiperazin-1-yl]-N-methyl-N-propan-2-ylpropanamide
CID 164637206
3-(4-(2-Morpholino-2-oxoethyl)piperazin-1-yl)-3-oxopropanenitrile
CID 168268653
2-[2,2-Dimethyl-4-(2,2,2-trifluoroethyl)piperazin-1-yl]-1-morpholin-4-ylethanone
CID 84598924
3,3,3-Trifluoro-1-[4-(1-morpholin-4-yl-1-oxopropan-2-yl)piperazin-1-yl]propan-1-one
CID 133575292

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1,2-dimorpholin-4-ylpropan-1-one?
The IUPAC name of 2-methyl-1,2-dimorpholin-4-ylpropan-1-one (CID 12595675) is 2-methyl-1,2-dimorpholin-4-ylpropan-1-one.
What is the SMILES notation for 2-methyl-1,2-dimorpholin-4-ylpropan-1-one?
The canonical SMILES for 2-methyl-1,2-dimorpholin-4-ylpropan-1-one is CC(C)(C(=O)N1CCOCC1)N1CCOCC1.
What is the InChIKey of 2-methyl-1,2-dimorpholin-4-ylpropan-1-one?
The InChIKey is CSGPRCMYAZMHKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O3/c1-12(2,14-5-9-17-10-6-14)11(15)13-3-7-16-8-4-13/h3-10H2,1-2H3.
What are the key properties of 2-methyl-1,2-dimorpholin-4-ylpropan-1-one?
2-methyl-1,2-dimorpholin-4-ylpropan-1-one has a molecular weight of 242.32 g/mol, XLogP of -0.04, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1,2-dimorpholin-4-ylpropan-1-one is sourced from PubChem (CID 12595675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).