2-methyl-4-thiophen-2-ylsulfonylmorpholine-2-carboxamide

C10H14N2O4S2 — CID 127247675

IUPAC2-methyl-4-thiophen-2-ylsulfonylmorpholine-2-carboxamide
SMILESCC1(C(N)=O)CN(S(=O)(=O)c2cccs2)CCO1
InChIInChI=1S/C10H14N2O4S2/c1-10(9(11)13)7-12(4-5-16-10)18(14,15)8-3-2-6-17-8/h2-3,6H,4-5,7H2,1H3,(H2,11,13)
InChIKeyWVAKYYPYBZDUPJ-UHFFFAOYSA-N
MW290.37 g/mol
LogP0.01
Rot. Bonds3

About 2-methyl-4-thiophen-2-ylsulfonylmorpholine-2-carboxamide

2-methyl-4-thiophen-2-ylsulfonylmorpholine-2-carboxamide (PubChem CID 127247675) has the molecular formula C10H14N2O4S2 and a molecular weight of 290.37 g/mol. Its IUPAC name is 2-methyl-4-thiophen-2-ylsulfonylmorpholine-2-carboxamide.

Molecular Properties

Compound Name2-methyl-4-thiophen-2-ylsulfonylmorpholine-2-carboxamide
PubChem CID127247675
Molecular FormulaC10H14N2O4S2
Molecular Weight290.37 g/mol
Exact Mass290.04
IUPAC Name2-methyl-4-thiophen-2-ylsulfonylmorpholine-2-carboxamide
SMILESCC1(C(N)=O)CN(S(=O)(=O)c2cccs2)CCO1
InChIInChI=1S/C10H14N2O4S2/c1-10(9(11)13)7-12(4-5-16-10)18(14,15)8-3-2-6-17-8/h2-3,6H,4-5,7H2,1H3,(H2,11,13)
InChIKeyWVAKYYPYBZDUPJ-UHFFFAOYSA-N
XLogP0.01
TPSA89.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 50.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-methyl-1-thiophen-2-ylsulfonylpiperidine-3-carboxylic acid
CID 63135547
1-(4-thiophen-2-ylsulfonyl-1-oxa-4,8-diazaspiro[4.5]decan-8-yl)ethanone
CID 7384380
(5S)-2-methyl-10-thiophen-2-ylsulfonyl-7-oxa-2,10-diazaspiro[4.6]undecane
CID 97471956
N-[4-(4-thiophen-2-ylsulfonylpiperazin-1-yl)sulfonylphenyl]acetamide
CID 3497946
1-thiophen-2-ylsulfonylpiperazin-4-ium
CID 7016013
(3R)-N-benzyl-3-methyl-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide
CID 95088355
(3S)-N-benzyl-3-methyl-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide
CID 95088354
1-thiophen-2-ylsulfonylpiperidine
CID 765823
(3S)-3-(morpholin-4-ylmethyl)-1-thiophen-2-ylsulfonylpyrrolidin-3-ol
CID 124992631
(4R,5R)-4-(propan-2-yloxymethyl)-9-thiophen-2-ylsulfonyl-6-oxa-9-azaspiro[4.5]decane
CID 97451871
4-thiophen-2-ylsulfonylthiomorpholine
CID 128941068
4-[[2-oxo-2-(4-thiophen-2-ylsulfonyl-1-oxa-4,8-diazaspiro[4.5]decan-8-yl)acetyl]amino]benzamide
CID 16823137

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-thiophen-2-ylsulfonylmorpholine-2-carboxamide?
The IUPAC name of 2-methyl-4-thiophen-2-ylsulfonylmorpholine-2-carboxamide (CID 127247675) is 2-methyl-4-thiophen-2-ylsulfonylmorpholine-2-carboxamide.
What is the SMILES notation for 2-methyl-4-thiophen-2-ylsulfonylmorpholine-2-carboxamide?
The canonical SMILES for 2-methyl-4-thiophen-2-ylsulfonylmorpholine-2-carboxamide is CC1(C(N)=O)CN(S(=O)(=O)c2cccs2)CCO1.
What is the InChIKey of 2-methyl-4-thiophen-2-ylsulfonylmorpholine-2-carboxamide?
The InChIKey is WVAKYYPYBZDUPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O4S2/c1-10(9(11)13)7-12(4-5-16-10)18(14,15)8-3-2-6-17-8/h2-3,6H,4-5,7H2,1H3,(H2,11,13).
What are the key properties of 2-methyl-4-thiophen-2-ylsulfonylmorpholine-2-carboxamide?
2-methyl-4-thiophen-2-ylsulfonylmorpholine-2-carboxamide has a molecular weight of 290.37 g/mol, XLogP of 0.01, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-thiophen-2-ylsulfonylmorpholine-2-carboxamide is sourced from PubChem (CID 127247675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).