2-(3-methylmorpholin-4-yl)-1-thiophen-2-ylethanone

C11H15NO2S — CID 43796416

IUPAC2-(3-methylmorpholin-4-yl)-1-thiophen-2-ylethanone
SMILESCC1COCCN1CC(=O)c1cccs1
InChIInChI=1S/C11H15NO2S/c1-9-8-14-5-4-12(9)7-10(13)11-3-2-6-15-11/h2-3,6,9H,4-5,7-8H2,1H3
InChIKeyBPRRPDHWJKMIRL-UHFFFAOYSA-N
MW225.31 g/mol
LogP1.65
Rot. Bonds3

About 2-(3-methylmorpholin-4-yl)-1-thiophen-2-ylethanone

2-(3-methylmorpholin-4-yl)-1-thiophen-2-ylethanone (PubChem CID 43796416) has the molecular formula C11H15NO2S and a molecular weight of 225.31 g/mol. Its IUPAC name is 2-(3-methylmorpholin-4-yl)-1-thiophen-2-ylethanone.

Molecular Properties

Compound Name2-(3-methylmorpholin-4-yl)-1-thiophen-2-ylethanone
PubChem CID43796416
Molecular FormulaC11H15NO2S
Molecular Weight225.31 g/mol
Exact Mass225.08
IUPAC Name2-(3-methylmorpholin-4-yl)-1-thiophen-2-ylethanone
SMILESCC1COCCN1CC(=O)c1cccs1
InChIInChI=1S/C11H15NO2S/c1-9-8-14-5-4-12(9)7-10(13)11-3-2-6-15-11/h2-3,6,9H,4-5,7-8H2,1H3
InChIKeyBPRRPDHWJKMIRL-UHFFFAOYSA-N
XLogP1.65
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.31
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(3-methylmorpholin-4-yl)-1-thiophen-2-ylethanone 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

N-methyl-4-(2-oxo-2-thiophen-2-ylethyl)morpholine-3-carboxamide
CID 83102887
4-(2-oxo-2-thiophen-2-ylethyl)-N-propan-2-ylmorpholine-3-carboxamide
CID 83103891
2-[(2R)-2-methylpiperazin-1-yl]-1-thiophen-2-ylethanone
CID 97163371
1-thiophen-2-yl-2-[4-(trimethylsilylmethyl)morpholin-3-yl]ethanone
CID 75478811
(2R)-2-[4-[2-[(3R)-3-methylmorpholin-4-yl]acetyl]piperazin-1-yl]-2-thiophen-2-ylacetonitrile
CID 124845882
2-[(3R)-4-(3-hydroxypropyl)morpholin-3-yl]-1-thiophen-2-ylethanone
CID 99579369
2-[(3R)-3-(2-oxo-2-thiophen-2-ylethyl)morpholin-4-yl]-N-phenylacetamide
CID 99699219
1-(2-fluorophenyl)-3-(3-methylmorpholin-4-yl)propan-2-one
CID 43796410
2-[(3S)-4-[[4-(hydroxymethyl)phenyl]methyl]morpholin-3-yl]-1-thiophen-2-ylethanone
CID 99578863
2-[4-[(2-methyl-1,2,4-triazol-3-yl)methyl]morpholin-3-yl]-1-thiophen-2-ylethanone
CID 86817699
1-(3-phenylmorpholin-4-yl)-4-thiophen-2-ylbutane-1,4-dione
CID 71993259
2-[4-[(2,6-dimethyl-3-pyridinyl)methyl]morpholin-3-yl]-1-thiophen-2-ylethanone
CID 119034502

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylmorpholin-4-yl)-1-thiophen-2-ylethanone?
The IUPAC name of 2-(3-methylmorpholin-4-yl)-1-thiophen-2-ylethanone (CID 43796416) is 2-(3-methylmorpholin-4-yl)-1-thiophen-2-ylethanone.
What is the SMILES notation for 2-(3-methylmorpholin-4-yl)-1-thiophen-2-ylethanone?
The canonical SMILES for 2-(3-methylmorpholin-4-yl)-1-thiophen-2-ylethanone is CC1COCCN1CC(=O)c1cccs1.
What is the InChIKey of 2-(3-methylmorpholin-4-yl)-1-thiophen-2-ylethanone?
The InChIKey is BPRRPDHWJKMIRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2S/c1-9-8-14-5-4-12(9)7-10(13)11-3-2-6-15-11/h2-3,6,9H,4-5,7-8H2,1H3.
What are the key properties of 2-(3-methylmorpholin-4-yl)-1-thiophen-2-ylethanone?
2-(3-methylmorpholin-4-yl)-1-thiophen-2-ylethanone has a molecular weight of 225.31 g/mol, XLogP of 1.65, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylmorpholin-4-yl)-1-thiophen-2-ylethanone is sourced from PubChem (CID 43796416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).