3-(piperazine-1-carbonyl)furan-2-sulfonamide

C9H13N3O4S — CID 152513607

IUPAC3-(piperazine-1-carbonyl)furan-2-sulfonamide
SMILESNS(=O)(=O)c1occc1C(=O)N1CCNCC1
InChIInChI=1S/C9H13N3O4S/c10-17(14,15)9-7(1-6-16-9)8(13)12-4-2-11-3-5-12/h1,6,11H,2-5H2,(H2,10,14,15)
InChIKeyYGANFYJCZAUAIV-UHFFFAOYSA-N
MW259.29 g/mol
LogP-1.03
Rot. Bonds2

About 3-(piperazine-1-carbonyl)furan-2-sulfonamide

3-(piperazine-1-carbonyl)furan-2-sulfonamide (PubChem CID 152513607) has the molecular formula C9H13N3O4S and a molecular weight of 259.29 g/mol. Its IUPAC name is 3-(piperazine-1-carbonyl)furan-2-sulfonamide.

Molecular Properties

Compound Name3-(piperazine-1-carbonyl)furan-2-sulfonamide
PubChem CID152513607
Molecular FormulaC9H13N3O4S
Molecular Weight259.29 g/mol
Exact Mass259.06
IUPAC Name3-(piperazine-1-carbonyl)furan-2-sulfonamide
SMILESNS(=O)(=O)c1occc1C(=O)N1CCNCC1
InChIInChI=1S/C9H13N3O4S/c10-17(14,15)9-7(1-6-16-9)8(13)12-4-2-11-3-5-12/h1,6,11H,2-5H2,(H2,10,14,15)
InChIKeyYGANFYJCZAUAIV-UHFFFAOYSA-N
XLogP-1.03
TPSA105.64 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.29
LogP ≤ 5-1.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

sodium S-(2-(4-(furan-3-carbonyl)piperazin-1-yl)-2-oxoethyl) sulfothioate
CID 23698195
N-(1-ethylsulfonylpiperidin-4-yl)furan-3-carboxamide
CID 40144210
N-(2-piperidin-1-ylethyl)furan-3-carboxamide
CID 45823667
N-(2-oxo-2-piperidin-1-ylethyl)furan-3-carboxamide
CID 45883933
1-(Furan-3-carbonyl)piperazine hydrochloride
CID 50988756
N-[2-(4-methylpiperidin-1-yl)ethyl]furan-3-carboxamide
CID 45823970
N-[3-[methylsulfonyl(propan-2-yl)amino]propyl]furan-3-carboxamide
CID 45824321
N-[3-oxo-3-[4-(3,3,3-trifluoropropanoyl)piperazin-1-yl]propyl]furan-3-carboxamide
CID 53548156
N-cyclopropyl-N-ethyl-5-(methylsulfamoyl)furan-3-carboxamide
CID 75432902
5-(dimethylsulfamoyl)-N-(1-ethylcyclobutyl)furan-3-carboxamide
CID 75432982
N,N-dimethyl-4-(1,2-oxazolidine-2-carbonyl)furan-2-sulfonamide
CID 75455368
N,N-dimethyl-4-[4-(2-methylpropyl)piperidine-1-carbonyl]furan-2-sulfonamide
CID 84590964

Frequently Asked Questions

What is the IUPAC name of 3-(piperazine-1-carbonyl)furan-2-sulfonamide?
The IUPAC name of 3-(piperazine-1-carbonyl)furan-2-sulfonamide (CID 152513607) is 3-(piperazine-1-carbonyl)furan-2-sulfonamide.
What is the SMILES notation for 3-(piperazine-1-carbonyl)furan-2-sulfonamide?
The canonical SMILES for 3-(piperazine-1-carbonyl)furan-2-sulfonamide is NS(=O)(=O)c1occc1C(=O)N1CCNCC1.
What is the InChIKey of 3-(piperazine-1-carbonyl)furan-2-sulfonamide?
The InChIKey is YGANFYJCZAUAIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O4S/c10-17(14,15)9-7(1-6-16-9)8(13)12-4-2-11-3-5-12/h1,6,11H,2-5H2,(H2,10,14,15).
What are the key properties of 3-(piperazine-1-carbonyl)furan-2-sulfonamide?
3-(piperazine-1-carbonyl)furan-2-sulfonamide has a molecular weight of 259.29 g/mol, XLogP of -1.03, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(piperazine-1-carbonyl)furan-2-sulfonamide is sourced from PubChem (CID 152513607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).