N-(2,3-dichlorophenyl)-3-piperidin-1-ylsulfonylpropanamide

C14H18Cl2N2O3S — CID 110342707

IUPACN-(2,3-dichlorophenyl)-3-piperidin-1-ylsulfonylpropanamide
SMILESO=C(CCS(=O)(=O)N1CCCCC1)Nc1cccc(Cl)c1Cl
InChIInChI=1S/C14H18Cl2N2O3S/c15-11-5-4-6-12(14(11)16)17-13(19)7-10-22(20,21)18-8-2-1-3-9-18/h4-6H,1-3,7-10H2,(H,17,19)
InChIKeyYEKFCVPVUWSRDG-UHFFFAOYSA-N
MW365.28 g/mol
LogP3.14
Rot. Bonds5

About N-(2,3-dichlorophenyl)-3-piperidin-1-ylsulfonylpropanamide

N-(2,3-dichlorophenyl)-3-piperidin-1-ylsulfonylpropanamide (PubChem CID 110342707) has the molecular formula C14H18Cl2N2O3S and a molecular weight of 365.28 g/mol. Its IUPAC name is N-(2,3-dichlorophenyl)-3-piperidin-1-ylsulfonylpropanamide.

Molecular Properties

Compound NameN-(2,3-dichlorophenyl)-3-piperidin-1-ylsulfonylpropanamide
PubChem CID110342707
Molecular FormulaC14H18Cl2N2O3S
Molecular Weight365.28 g/mol
Exact Mass364.04
IUPAC NameN-(2,3-dichlorophenyl)-3-piperidin-1-ylsulfonylpropanamide
SMILESO=C(CCS(=O)(=O)N1CCCCC1)Nc1cccc(Cl)c1Cl
InChIInChI=1S/C14H18Cl2N2O3S/c15-11-5-4-6-12(14(11)16)17-13(19)7-10-22(20,21)18-8-2-1-3-9-18/h4-6H,1-3,7-10H2,(H,17,19)
InChIKeyYEKFCVPVUWSRDG-UHFFFAOYSA-N
XLogP3.14
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.28
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-iodophenyl)-4-pyrrolidin-1-ylsulfonylbutanamide
CID 112844619
N,N'-bis(2,3-dichlorophenyl)dodecanediamide
CID 3641487
N-(2,3-dichlorophenyl)-3-(4-methoxyphenyl)sulfonylpropanamide
CID 41324012
N-(3-chloro-4-methoxyphenyl)-3-piperidin-1-ylsulfonylpropanamide
CID 110342661
N-(2,3-dichlorophenyl)-3-(4-methylpiperazin-1-yl)propanamide
CID 110864352
N-(2,3-dichlorophenyl)-2-[4-(2,3-dichlorophenyl)sulfonylpiperazin-1-yl]acetamide
CID 27186727
N-(4-bromophenyl)-3-pyrrolidin-1-ylsulfonylpropanamide
CID 110342560
3-cyclohexylsulfanyl-N-(2,3-dichlorophenyl)propanamide
CID 23917473
N-[2-(3-chlorophenyl)ethyl]-3-piperidin-1-ylsulfonylpropanamide
CID 110342653
2-(2,3-dichloroanilino)-N-(4-piperidin-1-ylsulfonylphenyl)acetamide
CID 42069796
N-(2,3-dichlorophenyl)-2-(2-oxo-2-piperidin-1-ylethoxy)acetamide
CID 4002670
N-(2,3-dichlorophenyl)-3-(4-formylpiperazin-1-yl)propanamide
CID 109018090

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dichlorophenyl)-3-piperidin-1-ylsulfonylpropanamide?
The IUPAC name of N-(2,3-dichlorophenyl)-3-piperidin-1-ylsulfonylpropanamide (CID 110342707) is N-(2,3-dichlorophenyl)-3-piperidin-1-ylsulfonylpropanamide.
What is the SMILES notation for N-(2,3-dichlorophenyl)-3-piperidin-1-ylsulfonylpropanamide?
The canonical SMILES for N-(2,3-dichlorophenyl)-3-piperidin-1-ylsulfonylpropanamide is O=C(CCS(=O)(=O)N1CCCCC1)Nc1cccc(Cl)c1Cl.
What is the InChIKey of N-(2,3-dichlorophenyl)-3-piperidin-1-ylsulfonylpropanamide?
The InChIKey is YEKFCVPVUWSRDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18Cl2N2O3S/c15-11-5-4-6-12(14(11)16)17-13(19)7-10-22(20,21)18-8-2-1-3-9-18/h4-6H,1-3,7-10H2,(H,17,19).
What are the key properties of N-(2,3-dichlorophenyl)-3-piperidin-1-ylsulfonylpropanamide?
N-(2,3-dichlorophenyl)-3-piperidin-1-ylsulfonylpropanamide has a molecular weight of 365.28 g/mol, XLogP of 3.14, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dichlorophenyl)-3-piperidin-1-ylsulfonylpropanamide is sourced from PubChem (CID 110342707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).