1-[3-(methylsulfamoyl)benzoyl]piperidine-4-carboxamide

C14H19N3O4S — CID 94786854

IUPAC1-[3-(methylsulfamoyl)benzoyl]piperidine-4-carboxamide
SMILESCNS(=O)(=O)c1cccc(C(=O)N2CCC(C(N)=O)CC2)c1
InChIInChI=1S/C14H19N3O4S/c1-16-22(20,21)12-4-2-3-11(9-12)14(19)17-7-5-10(6-8-17)13(15)18/h2-4,9-10,16H,5-8H2,1H3,(H2,15,18)
InChIKeyMNTRQQMFTCWKRQ-UHFFFAOYSA-N
MW325.39 g/mol
LogP-0.07
Rot. Bonds4

About 1-[3-(methylsulfamoyl)benzoyl]piperidine-4-carboxamide

1-[3-(methylsulfamoyl)benzoyl]piperidine-4-carboxamide (PubChem CID 94786854) has the molecular formula C14H19N3O4S and a molecular weight of 325.39 g/mol. Its IUPAC name is 1-[3-(methylsulfamoyl)benzoyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[3-(methylsulfamoyl)benzoyl]piperidine-4-carboxamide
PubChem CID94786854
Molecular FormulaC14H19N3O4S
Molecular Weight325.39 g/mol
Exact Mass325.11
IUPAC Name1-[3-(methylsulfamoyl)benzoyl]piperidine-4-carboxamide
SMILESCNS(=O)(=O)c1cccc(C(=O)N2CCC(C(N)=O)CC2)c1
InChIInChI=1S/C14H19N3O4S/c1-16-22(20,21)12-4-2-3-11(9-12)14(19)17-7-5-10(6-8-17)13(15)18/h2-4,9-10,16H,5-8H2,1H3,(H2,15,18)
InChIKeyMNTRQQMFTCWKRQ-UHFFFAOYSA-N
XLogP-0.07
TPSA109.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.39
LogP ≤ 5-0.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-3-(4-methylpiperazine-1-carbonyl)benzenesulfonamide
CID 51160647
1-[3-(ethylsulfamoyl)benzoyl]-N-methylpiperidine-4-carboxamide
CID 43064085
3-(3-cyclopropyl-3-hydroxyazetidine-1-carbonyl)-N-methylbenzenesulfonamide
CID 139007574
N-(cyclopropylmethyl)-3-[4-(methylamino)piperidine-1-carbonyl]benzenesulfonamide
CID 119563230
3-[4-(4-methylbenzoyl)piperidine-1-carbonyl]-N-(4-methylphenyl)benzenesulfonamide
CID 55956075
3-(4-aminopiperidine-1-carbonyl)-N-(cyclopropylmethyl)benzenesulfonamide
CID 119376148
1-(3-pyrrol-1-ylbenzoyl)piperidine-4-carboxamide
CID 39314575
1-[3-(chloromethyl)benzoyl]piperidine-4-carboxamide
CID 43333364
1-[5-(methylsulfamoyl)furan-2-carbonyl]piperidine-4-carboxamide
CID 39896620
3-[4-(aminomethyl)piperidine-1-carbonyl]-N-cyclopropylbenzenesulfonamide
CID 119423037
1-[3-(benzenesulfonamido)benzoyl]-N-methylpiperidine-4-carboxamide
CID 20974043
3-(4-aminopiperidine-1-carbonyl)-N-(3-methylphenyl)benzenesulfonamide
CID 119373314

Frequently Asked Questions

What is the IUPAC name of 1-[3-(methylsulfamoyl)benzoyl]piperidine-4-carboxamide?
The IUPAC name of 1-[3-(methylsulfamoyl)benzoyl]piperidine-4-carboxamide (CID 94786854) is 1-[3-(methylsulfamoyl)benzoyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-[3-(methylsulfamoyl)benzoyl]piperidine-4-carboxamide?
The canonical SMILES for 1-[3-(methylsulfamoyl)benzoyl]piperidine-4-carboxamide is CNS(=O)(=O)c1cccc(C(=O)N2CCC(C(N)=O)CC2)c1.
What is the InChIKey of 1-[3-(methylsulfamoyl)benzoyl]piperidine-4-carboxamide?
The InChIKey is MNTRQQMFTCWKRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O4S/c1-16-22(20,21)12-4-2-3-11(9-12)14(19)17-7-5-10(6-8-17)13(15)18/h2-4,9-10,16H,5-8H2,1H3,(H2,15,18).
What are the key properties of 1-[3-(methylsulfamoyl)benzoyl]piperidine-4-carboxamide?
1-[3-(methylsulfamoyl)benzoyl]piperidine-4-carboxamide has a molecular weight of 325.39 g/mol, XLogP of -0.07, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(methylsulfamoyl)benzoyl]piperidine-4-carboxamide is sourced from PubChem (CID 94786854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).