1-(2-chlorophenyl)-N-[2-(methylamino)propyl]methanesulfonamide

C11H17ClN2O2S — CID 120824558

IUPAC1-(2-chlorophenyl)-N-[2-(methylamino)propyl]methanesulfonamide
SMILESCNC(C)CNS(=O)(=O)Cc1ccccc1Cl
InChIInChI=1S/C11H17ClN2O2S/c1-9(13-2)7-14-17(15,16)8-10-5-3-4-6-11(10)12/h3-6,9,13-14H,7-8H2,1-2H3
InChIKeyWXZLKDMXDABXNW-UHFFFAOYSA-N
MW276.79 g/mol
LogP1.37
Rot. Bonds6

About 1-(2-chlorophenyl)-N-[2-(methylamino)propyl]methanesulfonamide

1-(2-chlorophenyl)-N-[2-(methylamino)propyl]methanesulfonamide (PubChem CID 120824558) has the molecular formula C11H17ClN2O2S and a molecular weight of 276.79 g/mol. Its IUPAC name is 1-(2-chlorophenyl)-N-[2-(methylamino)propyl]methanesulfonamide.

Molecular Properties

Compound Name1-(2-chlorophenyl)-N-[2-(methylamino)propyl]methanesulfonamide
PubChem CID120824558
Molecular FormulaC11H17ClN2O2S
Molecular Weight276.79 g/mol
Exact Mass276.07
IUPAC Name1-(2-chlorophenyl)-N-[2-(methylamino)propyl]methanesulfonamide
SMILESCNC(C)CNS(=O)(=O)Cc1ccccc1Cl
InChIInChI=1S/C11H17ClN2O2S/c1-9(13-2)7-14-17(15,16)8-10-5-3-4-6-11(10)12/h3-6,9,13-14H,7-8H2,1-2H3
InChIKeyWXZLKDMXDABXNW-UHFFFAOYSA-N
XLogP1.37
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.79
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-chlorophenyl)-N-(2-methylpropyl)methanesulfonamide
CID 17257571
1-(2-fluorophenyl)-N-[2-(methylamino)propyl]methanesulfonamide
CID 120824821
1-(2-chlorophenyl)-N-(6-methylheptan-2-yl)methanesulfonamide
CID 3647642
1-(2-chlorophenyl)-N-pentan-2-ylmethanesulfonamide
CID 17257591
1-(2-chlorophenyl)-N-(3-hydroxybutyl)methanesulfonamide
CID 111977012
N-(2-amino-2-phenylethyl)-1-(2-chlorophenyl)methanesulfonamide;hydrochloride
CID 84591502
1-(2-chlorophenyl)-N-[2-(4-chlorophenyl)-2-(dimethylamino)ethyl]methanesulfonamide
CID 112503749
N-[2-(methylamino)propyl]benzenesulfonamide
CID 103512552
1-(2-chlorophenyl)-N-[2-(5-chlorothiophen-2-yl)-2-methoxyethyl]methanesulfonamide
CID 121180260
1-(2-chlorophenyl)-N-heptylmethanesulfonamide
CID 17257569
1-(2-chlorophenyl)-N-[(1R)-1-(4-methylphenyl)ethyl]methanesulfonamide
CID 92673614
1-(2-chlorophenyl)-N-[(1R)-1-pyridin-4-ylethyl]methanesulfonamide
CID 95968877

Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenyl)-N-[2-(methylamino)propyl]methanesulfonamide?
The IUPAC name of 1-(2-chlorophenyl)-N-[2-(methylamino)propyl]methanesulfonamide (CID 120824558) is 1-(2-chlorophenyl)-N-[2-(methylamino)propyl]methanesulfonamide.
What is the SMILES notation for 1-(2-chlorophenyl)-N-[2-(methylamino)propyl]methanesulfonamide?
The canonical SMILES for 1-(2-chlorophenyl)-N-[2-(methylamino)propyl]methanesulfonamide is CNC(C)CNS(=O)(=O)Cc1ccccc1Cl.
What is the InChIKey of 1-(2-chlorophenyl)-N-[2-(methylamino)propyl]methanesulfonamide?
The InChIKey is WXZLKDMXDABXNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17ClN2O2S/c1-9(13-2)7-14-17(15,16)8-10-5-3-4-6-11(10)12/h3-6,9,13-14H,7-8H2,1-2H3.
What are the key properties of 1-(2-chlorophenyl)-N-[2-(methylamino)propyl]methanesulfonamide?
1-(2-chlorophenyl)-N-[2-(methylamino)propyl]methanesulfonamide has a molecular weight of 276.79 g/mol, XLogP of 1.37, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorophenyl)-N-[2-(methylamino)propyl]methanesulfonamide is sourced from PubChem (CID 120824558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).