1-(3,5-dichlorophenyl)-N-piperidin-4-yl-N-propylmethanesulfonamide

C15H22Cl2N2O2S — CID 119993752

IUPAC1-(3,5-dichlorophenyl)-N-piperidin-4-yl-N-propylmethanesulfonamide
SMILESCCCN(C1CCNCC1)S(=O)(=O)Cc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C15H22Cl2N2O2S/c1-2-7-19(15-3-5-18-6-4-15)22(20,21)11-12-8-13(16)10-14(17)9-12/h8-10,15,18H,2-7,11H2,1H3
InChIKeyPSOLCFJYOPEMJZ-UHFFFAOYSA-N
MW365.33 g/mol
LogP3.29
Rot. Bonds6

About 1-(3,5-dichlorophenyl)-N-piperidin-4-yl-N-propylmethanesulfonamide

1-(3,5-dichlorophenyl)-N-piperidin-4-yl-N-propylmethanesulfonamide (PubChem CID 119993752) has the molecular formula C15H22Cl2N2O2S and a molecular weight of 365.33 g/mol. Its IUPAC name is 1-(3,5-dichlorophenyl)-N-piperidin-4-yl-N-propylmethanesulfonamide.

Molecular Properties

Compound Name1-(3,5-dichlorophenyl)-N-piperidin-4-yl-N-propylmethanesulfonamide
PubChem CID119993752
Molecular FormulaC15H22Cl2N2O2S
Molecular Weight365.33 g/mol
Exact Mass364.08
IUPAC Name1-(3,5-dichlorophenyl)-N-piperidin-4-yl-N-propylmethanesulfonamide
SMILESCCCN(C1CCNCC1)S(=O)(=O)Cc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C15H22Cl2N2O2S/c1-2-7-19(15-3-5-18-6-4-15)22(20,21)11-12-8-13(16)10-14(17)9-12/h8-10,15,18H,2-7,11H2,1H3
InChIKeyPSOLCFJYOPEMJZ-UHFFFAOYSA-N
XLogP3.29
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.33
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(3,5-dichlorophenyl)-N-piperidin-4-yl-N-propylmethanesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(3,5-dichlorophenyl)-N-piperidin-4-yl-N-propylmethanesulfonamide;hydrochloride
CID 119993751
1-(3-methoxyphenyl)-N-piperidin-4-yl-N-propylmethanesulfonamide
CID 119993734
N-piperidin-4-yl-N-propyl-1-[3-(trifluoromethyl)phenyl]methanesulfonamide;hydrochloride
CID 119994035
methyl 3-[[piperidin-4-yl(propyl)sulfamoyl]methyl]benzoate;hydrochloride
CID 119994180
2,4,6-trichloro-N-propyl-N-pyrrolidin-3-ylbenzenesulfonamide
CID 63300848
N-propyl-N-pyrrolidin-3-ylethanesulfonamide
CID 60805146
5-chloro-4-methyl-N-piperidin-4-yl-N-propylthiophene-2-sulfonamide
CID 103100371
3-methyl-N-piperidin-4-yl-N-propylbutane-1-sulfonamide
CID 63855512
2-chloro-4-fluoro-N-piperidin-4-yl-N-propylbenzenesulfonamide
CID 60807123
2,3-dichloro-N-piperidin-4-yl-N-propylbenzenesulfonamide
CID 60806599
5-chloro-2-nitro-N-piperidin-4-yl-N-propylbenzenesulfonamide;hydrochloride
CID 119994172
N-(azetidin-3-yl)-3,5-dichloro-N-propylbenzenesulfonamide
CID 66215475

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-dichlorophenyl)-N-piperidin-4-yl-N-propylmethanesulfonamide?
The IUPAC name of 1-(3,5-dichlorophenyl)-N-piperidin-4-yl-N-propylmethanesulfonamide (CID 119993752) is 1-(3,5-dichlorophenyl)-N-piperidin-4-yl-N-propylmethanesulfonamide.
What is the SMILES notation for 1-(3,5-dichlorophenyl)-N-piperidin-4-yl-N-propylmethanesulfonamide?
The canonical SMILES for 1-(3,5-dichlorophenyl)-N-piperidin-4-yl-N-propylmethanesulfonamide is CCCN(C1CCNCC1)S(=O)(=O)Cc1cc(Cl)cc(Cl)c1.
What is the InChIKey of 1-(3,5-dichlorophenyl)-N-piperidin-4-yl-N-propylmethanesulfonamide?
The InChIKey is PSOLCFJYOPEMJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22Cl2N2O2S/c1-2-7-19(15-3-5-18-6-4-15)22(20,21)11-12-8-13(16)10-14(17)9-12/h8-10,15,18H,2-7,11H2,1H3.
What are the key properties of 1-(3,5-dichlorophenyl)-N-piperidin-4-yl-N-propylmethanesulfonamide?
1-(3,5-dichlorophenyl)-N-piperidin-4-yl-N-propylmethanesulfonamide has a molecular weight of 365.33 g/mol, XLogP of 3.29, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dichlorophenyl)-N-piperidin-4-yl-N-propylmethanesulfonamide is sourced from PubChem (CID 119993752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).