1-[1-(dimethylsulfamoyl)azetidin-3-yl]piperidine-4-carboxamide

C11H22N4O3S — CID 121154190

IUPAC1-[1-(dimethylsulfamoyl)azetidin-3-yl]piperidine-4-carboxamide
SMILESCN(C)S(=O)(=O)N1CC(N2CCC(C(N)=O)CC2)C1
InChIInChI=1S/C11H22N4O3S/c1-13(2)19(17,18)15-7-10(8-15)14-5-3-9(4-6-14)11(12)16/h9-10H,3-8H2,1-2H3,(H2,12,16)
InChIKeyBKLQAXWKJGCNPD-UHFFFAOYSA-N
MW290.39 g/mol
LogP-1.33
Rot. Bonds4

About 1-[1-(dimethylsulfamoyl)azetidin-3-yl]piperidine-4-carboxamide

1-[1-(dimethylsulfamoyl)azetidin-3-yl]piperidine-4-carboxamide (PubChem CID 121154190) has the molecular formula C11H22N4O3S and a molecular weight of 290.39 g/mol. Its IUPAC name is 1-[1-(dimethylsulfamoyl)azetidin-3-yl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[1-(dimethylsulfamoyl)azetidin-3-yl]piperidine-4-carboxamide
PubChem CID121154190
Molecular FormulaC11H22N4O3S
Molecular Weight290.39 g/mol
Exact Mass290.14
IUPAC Name1-[1-(dimethylsulfamoyl)azetidin-3-yl]piperidine-4-carboxamide
SMILESCN(C)S(=O)(=O)N1CC(N2CCC(C(N)=O)CC2)C1
InChIInChI=1S/C11H22N4O3S/c1-13(2)19(17,18)15-7-10(8-15)14-5-3-9(4-6-14)11(12)16/h9-10H,3-8H2,1-2H3,(H2,12,16)
InChIKeyBKLQAXWKJGCNPD-UHFFFAOYSA-N
XLogP-1.33
TPSA86.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.39
LogP ≤ 5-1.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(1-methylazetidin-3-yl)piperidine-4-carboxamide
CID 166069617
1-[1-(4-ethylphenyl)sulfonylazetidin-3-yl]piperidine-4-carboxamide
CID 121154139
1-[1-(2,6-difluorophenyl)sulfonylazetidin-3-yl]piperidine-4-carboxamide
CID 121154153
1-[1-(3-chloro-2-methylphenyl)sulfonylazetidin-3-yl]piperidine-4-carboxamide
CID 121154164
1-[1-(5-ethylthiophen-2-yl)sulfonylazetidin-3-yl]piperidine-4-carboxamide
CID 121154148
1-[1-[4-(trifluoromethyl)phenyl]sulfonylazetidin-3-yl]piperidine-4-carboxamide
CID 121154179
2-cyclopropyl-N,N-dimethyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-sulfonamide
CID 121185681
4-(cyclopropanecarbonyl)-N,N-dimethylpiperazine-1-sulfonamide
CID 60738795
1-[1-(2-cyanophenyl)sulfonylazetidin-3-yl]piperidine-4-carboxamide
CID 121154210
4-carbamoylpiperidine-1-sulfonyl chloride
CID 16786397
1-propylsulfonylpiperidine-4-carboxamide
CID 6473107
1-[3-[methyl-(1-methylpiperidin-4-yl)sulfamoyl]propyl]piperidine-4-carboxamide
CID 69358248

Frequently Asked Questions

What is the IUPAC name of 1-[1-(dimethylsulfamoyl)azetidin-3-yl]piperidine-4-carboxamide?
The IUPAC name of 1-[1-(dimethylsulfamoyl)azetidin-3-yl]piperidine-4-carboxamide (CID 121154190) is 1-[1-(dimethylsulfamoyl)azetidin-3-yl]piperidine-4-carboxamide.
What is the SMILES notation for 1-[1-(dimethylsulfamoyl)azetidin-3-yl]piperidine-4-carboxamide?
The canonical SMILES for 1-[1-(dimethylsulfamoyl)azetidin-3-yl]piperidine-4-carboxamide is CN(C)S(=O)(=O)N1CC(N2CCC(C(N)=O)CC2)C1.
What is the InChIKey of 1-[1-(dimethylsulfamoyl)azetidin-3-yl]piperidine-4-carboxamide?
The InChIKey is BKLQAXWKJGCNPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N4O3S/c1-13(2)19(17,18)15-7-10(8-15)14-5-3-9(4-6-14)11(12)16/h9-10H,3-8H2,1-2H3,(H2,12,16).
What are the key properties of 1-[1-(dimethylsulfamoyl)azetidin-3-yl]piperidine-4-carboxamide?
1-[1-(dimethylsulfamoyl)azetidin-3-yl]piperidine-4-carboxamide has a molecular weight of 290.39 g/mol, XLogP of -1.33, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(dimethylsulfamoyl)azetidin-3-yl]piperidine-4-carboxamide is sourced from PubChem (CID 121154190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).