morpholin-4-yl-(5-piperidin-1-ylsulfonylthiophen-3-yl)methanone

C14H20N2O4S2 — CID 50777436

IUPACmorpholin-4-yl-(5-piperidin-1-ylsulfonylthiophen-3-yl)methanone
SMILESO=C(c1csc(S(=O)(=O)N2CCCCC2)c1)N1CCOCC1
InChIInChI=1S/C14H20N2O4S2/c17-14(15-6-8-20-9-7-15)12-10-13(21-11-12)22(18,19)16-4-2-1-3-5-16/h10-11H,1-9H2
InChIKeyKOMXPAKPYIFXTE-UHFFFAOYSA-N
MW344.46 g/mol
LogP1.40
Rot. Bonds3

About morpholin-4-yl-(5-piperidin-1-ylsulfonylthiophen-3-yl)methanone

morpholin-4-yl-(5-piperidin-1-ylsulfonylthiophen-3-yl)methanone (PubChem CID 50777436) has the molecular formula C14H20N2O4S2 and a molecular weight of 344.46 g/mol. Its IUPAC name is morpholin-4-yl-(5-piperidin-1-ylsulfonylthiophen-3-yl)methanone.

Molecular Properties

Compound Namemorpholin-4-yl-(5-piperidin-1-ylsulfonylthiophen-3-yl)methanone
PubChem CID50777436
Molecular FormulaC14H20N2O4S2
Molecular Weight344.46 g/mol
Exact Mass344.09
IUPAC Namemorpholin-4-yl-(5-piperidin-1-ylsulfonylthiophen-3-yl)methanone
SMILESO=C(c1csc(S(=O)(=O)N2CCCCC2)c1)N1CCOCC1
InChIInChI=1S/C14H20N2O4S2/c17-14(15-6-8-20-9-7-15)12-10-13(21-11-12)22(18,19)16-4-2-1-3-5-16/h10-11H,1-9H2
InChIKeyKOMXPAKPYIFXTE-UHFFFAOYSA-N
XLogP1.40
TPSA66.92 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.46
LogP ≤ 51.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

[5-(azepan-1-ylsulfonyl)thiophen-3-yl]-piperidin-1-ylmethanone
CID 50777756
[5-(4-methylpiperidin-1-yl)sulfonylthiophen-3-yl]-piperidin-1-ylmethanone
CID 50777781
[5-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonylthiophen-3-yl]-morpholin-4-ylmethanone
CID 50777841
2,3-dihydroindol-1-yl-[1-[4-(morpholine-4-carbonyl)thiophen-2-yl]sulfonylpiperidin-4-yl]methanone
CID 53074769
piperidin-1-yl-[5-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylthiophen-3-yl]methanone
CID 50777455
N-(1,3-benzodioxol-5-yl)-1-[4-(morpholine-4-carbonyl)thiophen-2-yl]sulfonylpiperidine-4-carboxamide
CID 53074777
(4-amino-3,3-dimethylpiperidin-1-yl)-(5-morpholin-4-ylsulfonylthiophen-3-yl)methanone
CID 120815056
N-(6-methyl-2-pyridinyl)-1-[4-(morpholine-4-carbonyl)thiophen-2-yl]sulfonylpiperidine-4-carboxamide
CID 53074753
4-(piperidine-1-carbonyl)thiophene-2-sulfonamide
CID 51270491
4-(azocane-1-carbonyl)thiophene-2-sulfonyl chloride
CID 65372779
N-[(3-methylphenyl)methyl]-1-[4-(morpholine-4-carbonyl)thiophen-2-yl]sulfonylpiperidine-4-carboxamide
CID 53074793
N-(3-methyl-2-pyridinyl)-1-[4-(morpholine-4-carbonyl)thiophen-2-yl]sulfonylpiperidine-4-carboxamide
CID 53074752

Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl-(5-piperidin-1-ylsulfonylthiophen-3-yl)methanone?
The IUPAC name of morpholin-4-yl-(5-piperidin-1-ylsulfonylthiophen-3-yl)methanone (CID 50777436) is morpholin-4-yl-(5-piperidin-1-ylsulfonylthiophen-3-yl)methanone.
What is the SMILES notation for morpholin-4-yl-(5-piperidin-1-ylsulfonylthiophen-3-yl)methanone?
The canonical SMILES for morpholin-4-yl-(5-piperidin-1-ylsulfonylthiophen-3-yl)methanone is O=C(c1csc(S(=O)(=O)N2CCCCC2)c1)N1CCOCC1.
What is the InChIKey of morpholin-4-yl-(5-piperidin-1-ylsulfonylthiophen-3-yl)methanone?
The InChIKey is KOMXPAKPYIFXTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O4S2/c17-14(15-6-8-20-9-7-15)12-10-13(21-11-12)22(18,19)16-4-2-1-3-5-16/h10-11H,1-9H2.
What are the key properties of morpholin-4-yl-(5-piperidin-1-ylsulfonylthiophen-3-yl)methanone?
morpholin-4-yl-(5-piperidin-1-ylsulfonylthiophen-3-yl)methanone has a molecular weight of 344.46 g/mol, XLogP of 1.40, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-(5-piperidin-1-ylsulfonylthiophen-3-yl)methanone is sourced from PubChem (CID 50777436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).