[2-(morpholin-4-ylsulfonylmethyl)morpholin-4-yl]-thiophen-2-ylmethanone

C14H20N2O5S2 — CID 126822086

IUPAC[2-(morpholin-4-ylsulfonylmethyl)morpholin-4-yl]-thiophen-2-ylmethanone
SMILESO=C(c1cccs1)N1CCOC(CS(=O)(=O)N2CCOCC2)C1
InChIInChI=1S/C14H20N2O5S2/c17-14(13-2-1-9-22-13)15-3-8-21-12(10-15)11-23(18,19)16-4-6-20-7-5-16/h1-2,9,12H,3-8,10-11H2
InChIKeyQIGTWXAVJCLNJN-UHFFFAOYSA-N
MW360.46 g/mol
LogP0.25
Rot. Bonds4

About [2-(morpholin-4-ylsulfonylmethyl)morpholin-4-yl]-thiophen-2-ylmethanone

[2-(morpholin-4-ylsulfonylmethyl)morpholin-4-yl]-thiophen-2-ylmethanone (PubChem CID 126822086) has the molecular formula C14H20N2O5S2 and a molecular weight of 360.46 g/mol. Its IUPAC name is [2-(morpholin-4-ylsulfonylmethyl)morpholin-4-yl]-thiophen-2-ylmethanone.

Molecular Properties

Compound Name[2-(morpholin-4-ylsulfonylmethyl)morpholin-4-yl]-thiophen-2-ylmethanone
PubChem CID126822086
Molecular FormulaC14H20N2O5S2
Molecular Weight360.46 g/mol
Exact Mass360.08
IUPAC Name[2-(morpholin-4-ylsulfonylmethyl)morpholin-4-yl]-thiophen-2-ylmethanone
SMILESO=C(c1cccs1)N1CCOC(CS(=O)(=O)N2CCOCC2)C1
InChIInChI=1S/C14H20N2O5S2/c17-14(13-2-1-9-22-13)15-3-8-21-12(10-15)11-23(18,19)16-4-6-20-7-5-16/h1-2,9,12H,3-8,10-11H2
InChIKeyQIGTWXAVJCLNJN-UHFFFAOYSA-N
XLogP0.25
TPSA76.15 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.46
LogP ≤ 50.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

[3-(morpholin-4-ylsulfonylmethyl)azetidin-1-yl]-thiophen-2-ylmethanone
CID 125423656
2-[4-(thiophene-2-carbonyl)morpholin-2-yl]acetic acid
CID 66421346
[(2R)-2-(cyclohexylmethyl)morpholin-4-yl]-thiophen-2-ylmethanone
CID 42245309
(4-morpholin-4-ylsulfonylpiperazin-1-yl)-thiophen-2-ylmethanone
CID 1256130
[(2S)-2-(2-pyrimidin-4-ylethyl)morpholin-4-yl]-thiophen-2-ylmethanone
CID 124986520
[(2R)-2-(2-pyrimidin-4-ylethyl)morpholin-4-yl]-thiophen-2-ylmethanone
CID 124986519
[4-(chloromethylsulfonyl)piperazin-1-yl]-thiophen-2-ylmethanone
CID 63664693
naphthalen-2-yl-[4-[[(2S)-4-(thiophene-2-carbonyl)morpholin-2-yl]methyl]-1,4-diazepan-1-yl]methanone
CID 93338782
[2-(4-fluorophenyl)morpholin-4-yl]-thiophen-2-ylmethanone
CID 42949369
[3-(morpholin-4-ylsulfonylmethyl)piperidin-1-yl]-phenylmethanone
CID 122155789
(3-phenylpyrrolidin-1-yl)-thiophen-2-ylmethanone
CID 2908197
N-[2-[2-(hydroxymethyl)morpholin-4-yl]-2-oxoethyl]thiophene-2-carboxamide
CID 81208598

Frequently Asked Questions

What is the IUPAC name of [2-(morpholin-4-ylsulfonylmethyl)morpholin-4-yl]-thiophen-2-ylmethanone?
The IUPAC name of [2-(morpholin-4-ylsulfonylmethyl)morpholin-4-yl]-thiophen-2-ylmethanone (CID 126822086) is [2-(morpholin-4-ylsulfonylmethyl)morpholin-4-yl]-thiophen-2-ylmethanone.
What is the SMILES notation for [2-(morpholin-4-ylsulfonylmethyl)morpholin-4-yl]-thiophen-2-ylmethanone?
The canonical SMILES for [2-(morpholin-4-ylsulfonylmethyl)morpholin-4-yl]-thiophen-2-ylmethanone is O=C(c1cccs1)N1CCOC(CS(=O)(=O)N2CCOCC2)C1.
What is the InChIKey of [2-(morpholin-4-ylsulfonylmethyl)morpholin-4-yl]-thiophen-2-ylmethanone?
The InChIKey is QIGTWXAVJCLNJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O5S2/c17-14(13-2-1-9-22-13)15-3-8-21-12(10-15)11-23(18,19)16-4-6-20-7-5-16/h1-2,9,12H,3-8,10-11H2.
What are the key properties of [2-(morpholin-4-ylsulfonylmethyl)morpholin-4-yl]-thiophen-2-ylmethanone?
[2-(morpholin-4-ylsulfonylmethyl)morpholin-4-yl]-thiophen-2-ylmethanone has a molecular weight of 360.46 g/mol, XLogP of 0.25, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(morpholin-4-ylsulfonylmethyl)morpholin-4-yl]-thiophen-2-ylmethanone is sourced from PubChem (CID 126822086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).