1-(azetidin-2-yl)-N-(3-chlorophenyl)methanesulfonamide

C10H13ClN2O2S — CID 115071237

IUPAC1-(azetidin-2-yl)-N-(3-chlorophenyl)methanesulfonamide
SMILESO=S(=O)(CC1CCN1)Nc1cccc(Cl)c1
InChIInChI=1S/C10H13ClN2O2S/c11-8-2-1-3-9(6-8)13-16(14,15)7-10-4-5-12-10/h1-3,6,10,12-13H,4-5,7H2
InChIKeyGGKVWMULJYRZOX-UHFFFAOYSA-N
MW260.75 g/mol
LogP1.44
Rot. Bonds4

About 1-(azetidin-2-yl)-N-(3-chlorophenyl)methanesulfonamide

1-(azetidin-2-yl)-N-(3-chlorophenyl)methanesulfonamide (PubChem CID 115071237) has the molecular formula C10H13ClN2O2S and a molecular weight of 260.75 g/mol. Its IUPAC name is 1-(azetidin-2-yl)-N-(3-chlorophenyl)methanesulfonamide.

Molecular Properties

Compound Name1-(azetidin-2-yl)-N-(3-chlorophenyl)methanesulfonamide
PubChem CID115071237
Molecular FormulaC10H13ClN2O2S
Molecular Weight260.75 g/mol
Exact Mass260.04
IUPAC Name1-(azetidin-2-yl)-N-(3-chlorophenyl)methanesulfonamide
SMILESO=S(=O)(CC1CCN1)Nc1cccc(Cl)c1
InChIInChI=1S/C10H13ClN2O2S/c11-8-2-1-3-9(6-8)13-16(14,15)7-10-4-5-12-10/h1-3,6,10,12-13H,4-5,7H2
InChIKeyGGKVWMULJYRZOX-UHFFFAOYSA-N
XLogP1.44
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.75
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-chlorophenyl)cyclopropanesulfonamide
CID 45497298
1-(azetidin-2-yl)-N-(4-methylphenyl)methanesulfonamide
CID 115071249
N-phenyl-1-piperidin-2-ylmethanesulfonamide
CID 54974221
N-(3-chlorophenyl)-1-(cyclopropylamino)propane-2-sulfonamide
CID 106060415
N-(2-chlorophenyl)-1-pyrrolidin-2-ylmethanesulfonamide
CID 54973701
3-[(3-chlorophenyl)sulfamoyl]-N-(pyrrolidin-2-ylmethyl)benzamide;hydrochloride
CID 119513853
N-(3-cyanophenyl)-1-(oxolan-2-yl)methanesulfonamide
CID 63247332
1-(3-chlorophenyl)-N-[[(2R)-pyrrolidin-2-yl]methyl]methanesulfonamide
CID 122557133
1-(azetidin-2-yl)-N-[(2-hydroxyphenyl)methyl]methanesulfonamide
CID 115071276
N-(2-chloro-4-iodophenyl)-1-piperidin-2-ylmethanesulfonamide
CID 107605719
N-(1-benzothiophen-5-yl)-1-piperidin-2-ylmethanesulfonamide
CID 65450515
N-[3-(dimethylamino)-4-methylphenyl]-1-piperidin-2-ylmethanesulfonamide
CID 115378310

Frequently Asked Questions

What is the IUPAC name of 1-(azetidin-2-yl)-N-(3-chlorophenyl)methanesulfonamide?
The IUPAC name of 1-(azetidin-2-yl)-N-(3-chlorophenyl)methanesulfonamide (CID 115071237) is 1-(azetidin-2-yl)-N-(3-chlorophenyl)methanesulfonamide.
What is the SMILES notation for 1-(azetidin-2-yl)-N-(3-chlorophenyl)methanesulfonamide?
The canonical SMILES for 1-(azetidin-2-yl)-N-(3-chlorophenyl)methanesulfonamide is O=S(=O)(CC1CCN1)Nc1cccc(Cl)c1.
What is the InChIKey of 1-(azetidin-2-yl)-N-(3-chlorophenyl)methanesulfonamide?
The InChIKey is GGKVWMULJYRZOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClN2O2S/c11-8-2-1-3-9(6-8)13-16(14,15)7-10-4-5-12-10/h1-3,6,10,12-13H,4-5,7H2.
What are the key properties of 1-(azetidin-2-yl)-N-(3-chlorophenyl)methanesulfonamide?
1-(azetidin-2-yl)-N-(3-chlorophenyl)methanesulfonamide has a molecular weight of 260.75 g/mol, XLogP of 1.44, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(azetidin-2-yl)-N-(3-chlorophenyl)methanesulfonamide is sourced from PubChem (CID 115071237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).