5-(4-methylpiperidine-1-carbonyl)furan-2-sulfonamide

C11H16N2O4S — CID 47176543

IUPAC5-(4-methylpiperidine-1-carbonyl)furan-2-sulfonamide
SMILESCC1CCN(C(=O)c2ccc(S(N)(=O)=O)o2)CC1
InChIInChI=1S/C11H16N2O4S/c1-8-4-6-13(7-5-8)11(14)9-2-3-10(17-9)18(12,15)16/h2-3,8H,4-7H2,1H3,(H2,12,15,16)
InChIKeyHWVJWDOIVNHASE-UHFFFAOYSA-N
MW272.33 g/mol
LogP0.80
Rot. Bonds2

About 5-(4-methylpiperidine-1-carbonyl)furan-2-sulfonamide

5-(4-methylpiperidine-1-carbonyl)furan-2-sulfonamide (PubChem CID 47176543) has the molecular formula C11H16N2O4S and a molecular weight of 272.33 g/mol. Its IUPAC name is 5-(4-methylpiperidine-1-carbonyl)furan-2-sulfonamide.

Molecular Properties

Compound Name5-(4-methylpiperidine-1-carbonyl)furan-2-sulfonamide
PubChem CID47176543
Molecular FormulaC11H16N2O4S
Molecular Weight272.33 g/mol
Exact Mass272.08
IUPAC Name5-(4-methylpiperidine-1-carbonyl)furan-2-sulfonamide
SMILESCC1CCN(C(=O)c2ccc(S(N)(=O)=O)o2)CC1
InChIInChI=1S/C11H16N2O4S/c1-8-4-6-13(7-5-8)11(14)9-2-3-10(17-9)18(12,15)16/h2-3,8H,4-7H2,1H3,(H2,12,15,16)
InChIKeyHWVJWDOIVNHASE-UHFFFAOYSA-N
XLogP0.80
TPSA93.61 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.33
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(4-methylpiperidin-1-yl)-[1-(5-piperidin-1-ylsulfonylfuran-2-carbonyl)piperidin-4-yl]methanone
CID 55950973
1-[5-(methylsulfamoyl)furan-2-carbonyl]piperidine-4-carboxamide
CID 39896620
5-(2,5-dimethylmorpholine-4-carbonyl)furan-2-sulfonamide
CID 47412717
5-(4-amino-3,3-dimethylpiperidine-1-carbonyl)-N,N-dimethylfuran-2-sulfonamide
CID 120815864
N-cyclohexyl-N-methyl-5-sulfamoylfuran-2-carboxamide
CID 47323040
(2,6-dimethylphenyl)-(4-methylpiperidin-1-yl)methanone
CID 142823511
(6-bromo-1-benzofuran-2-yl)-(4-methylpiperidin-1-yl)methanone
CID 84576723
2-(4-methylpiperidine-1-carbonyl)chromen-4-one
CID 26773752
methyl 5-sulfamoylfuran-2-carboxylate
CID 3146896
5-[4-(3-methylpyrrolidine-1-carbonyl)piperidin-1-yl]sulfonylfuran-2-carboxylic acid
CID 119184796
5-chloro-2-methyl-3-(4-methylpiperidine-1-carbonyl)benzenesulfonamide
CID 82878062
N-methyl-5-(4-oxopiperidine-1-carbonyl)furan-2-sulfonamide
CID 112531251

Frequently Asked Questions

What is the IUPAC name of 5-(4-methylpiperidine-1-carbonyl)furan-2-sulfonamide?
The IUPAC name of 5-(4-methylpiperidine-1-carbonyl)furan-2-sulfonamide (CID 47176543) is 5-(4-methylpiperidine-1-carbonyl)furan-2-sulfonamide.
What is the SMILES notation for 5-(4-methylpiperidine-1-carbonyl)furan-2-sulfonamide?
The canonical SMILES for 5-(4-methylpiperidine-1-carbonyl)furan-2-sulfonamide is CC1CCN(C(=O)c2ccc(S(N)(=O)=O)o2)CC1.
What is the InChIKey of 5-(4-methylpiperidine-1-carbonyl)furan-2-sulfonamide?
The InChIKey is HWVJWDOIVNHASE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O4S/c1-8-4-6-13(7-5-8)11(14)9-2-3-10(17-9)18(12,15)16/h2-3,8H,4-7H2,1H3,(H2,12,15,16).
What are the key properties of 5-(4-methylpiperidine-1-carbonyl)furan-2-sulfonamide?
5-(4-methylpiperidine-1-carbonyl)furan-2-sulfonamide has a molecular weight of 272.33 g/mol, XLogP of 0.80, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methylpiperidine-1-carbonyl)furan-2-sulfonamide is sourced from PubChem (CID 47176543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).