(1-morpholin-4-yl-1-oxopropan-2-yl) 2-(thiophen-2-ylsulfonylamino)acetate

C13H18N2O6S2 — CID 55705049

IUPAC(1-morpholin-4-yl-1-oxopropan-2-yl) 2-(thiophen-2-ylsulfonylamino)acetate
SMILESCC(OC(=O)CNS(=O)(=O)c1cccs1)C(=O)N1CCOCC1
InChIInChI=1S/C13H18N2O6S2/c1-10(13(17)15-4-6-20-7-5-15)21-11(16)9-14-23(18,19)12-3-2-8-22-12/h2-3,8,10,14H,4-7,9H2,1H3
InChIKeyMUVMKZAFJPDYCB-UHFFFAOYSA-N
MW362.43 g/mol
LogP-0.18
Rot. Bonds6

About (1-morpholin-4-yl-1-oxopropan-2-yl) 2-(thiophen-2-ylsulfonylamino)acetate

(1-morpholin-4-yl-1-oxopropan-2-yl) 2-(thiophen-2-ylsulfonylamino)acetate (PubChem CID 55705049) has the molecular formula C13H18N2O6S2 and a molecular weight of 362.43 g/mol. Its IUPAC name is (1-morpholin-4-yl-1-oxopropan-2-yl) 2-(thiophen-2-ylsulfonylamino)acetate.

Molecular Properties

Compound Name(1-morpholin-4-yl-1-oxopropan-2-yl) 2-(thiophen-2-ylsulfonylamino)acetate
PubChem CID55705049
Molecular FormulaC13H18N2O6S2
Molecular Weight362.43 g/mol
Exact Mass362.06
IUPAC Name(1-morpholin-4-yl-1-oxopropan-2-yl) 2-(thiophen-2-ylsulfonylamino)acetate
SMILESCC(OC(=O)CNS(=O)(=O)c1cccs1)C(=O)N1CCOCC1
InChIInChI=1S/C13H18N2O6S2/c1-10(13(17)15-4-6-20-7-5-15)21-11(16)9-14-23(18,19)12-3-2-8-22-12/h2-3,8,10,14H,4-7,9H2,1H3
InChIKeyMUVMKZAFJPDYCB-UHFFFAOYSA-N
XLogP-0.18
TPSA102.01 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.43
LogP ≤ 5-0.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-[(2S)-4-methyl-1-morpholin-4-yl-1-oxopentan-2-yl]thiophene-2-sulfonamide
CID 110285618
[1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxopropan-2-yl] 2-(thiophen-2-ylsulfonylamino)acetate
CID 43065296
N-[1-(4-morpholin-4-ylphenyl)ethyl]-2-(thiophen-2-ylsulfonylamino)acetamide
CID 48681561
N-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]thiophene-2-sulfonamide
CID 39888506
(1-morpholin-4-yl-1-oxopropan-2-yl) 2-(2-thiophen-2-yl-1,3-thiazol-4-yl)acetate
CID 46826877
(2S)-1-morpholin-4-yl-2-(1-thiophen-2-ylsulfonylpiperidin-4-yl)propan-1-one
CID 95088696
[1-[(2-cyano-3-methylbutan-2-yl)amino]-1-oxopropan-2-yl] 2-(thiophen-2-ylsulfonylamino)acetate
CID 46403872
N-[2-(2-methoxyphenyl)-2-morpholin-4-ylethyl]thiophene-2-sulfonamide
CID 112504149
(1-morpholin-4-yl-1-oxopropan-2-yl) 2-[(3-methylbenzoyl)amino]acetate
CID 46789775
N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)thiophene-2-sulfonamide
CID 45003189
N-[2-(4-formylpiperazin-1-yl)-2-oxoethyl]thiophene-2-sulfonamide
CID 112991880
N-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl]thiophene-2-sulfonamide
CID 5183080

Frequently Asked Questions

What is the IUPAC name of (1-morpholin-4-yl-1-oxopropan-2-yl) 2-(thiophen-2-ylsulfonylamino)acetate?
The IUPAC name of (1-morpholin-4-yl-1-oxopropan-2-yl) 2-(thiophen-2-ylsulfonylamino)acetate (CID 55705049) is (1-morpholin-4-yl-1-oxopropan-2-yl) 2-(thiophen-2-ylsulfonylamino)acetate.
What is the SMILES notation for (1-morpholin-4-yl-1-oxopropan-2-yl) 2-(thiophen-2-ylsulfonylamino)acetate?
The canonical SMILES for (1-morpholin-4-yl-1-oxopropan-2-yl) 2-(thiophen-2-ylsulfonylamino)acetate is CC(OC(=O)CNS(=O)(=O)c1cccs1)C(=O)N1CCOCC1.
What is the InChIKey of (1-morpholin-4-yl-1-oxopropan-2-yl) 2-(thiophen-2-ylsulfonylamino)acetate?
The InChIKey is MUVMKZAFJPDYCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O6S2/c1-10(13(17)15-4-6-20-7-5-15)21-11(16)9-14-23(18,19)12-3-2-8-22-12/h2-3,8,10,14H,4-7,9H2,1H3.
What are the key properties of (1-morpholin-4-yl-1-oxopropan-2-yl) 2-(thiophen-2-ylsulfonylamino)acetate?
(1-morpholin-4-yl-1-oxopropan-2-yl) 2-(thiophen-2-ylsulfonylamino)acetate has a molecular weight of 362.43 g/mol, XLogP of -0.18, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (1-morpholin-4-yl-1-oxopropan-2-yl) 2-(thiophen-2-ylsulfonylamino)acetate is sourced from PubChem (CID 55705049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).