2,5-dichloro-N-(2-methylpiperidin-4-yl)thiophene-3-sulfonamide;hydrochloride

C10H15Cl3N2O2S2 — CID 120585748

IUPAC2,5-dichloro-N-(2-methylpiperidin-4-yl)thiophene-3-sulfonamide;hydrochloride
SMILESCC1CC(NS(=O)(=O)c2cc(Cl)sc2Cl)CCN1.Cl
InChIInChI=1S/C10H14Cl2N2O2S2.ClH/c1-6-4-7(2-3-13-6)14-18(15,16)8-5-9(11)17-10(8)12;/h5-7,13-14H,2-4H2,1H3;1H
InChIKeyKBVQNYWAYSSPIW-UHFFFAOYSA-N
MW365.74 g/mol
LogP2.90
Rot. Bonds3

About 2,5-dichloro-N-(2-methylpiperidin-4-yl)thiophene-3-sulfonamide;hydrochloride

2,5-dichloro-N-(2-methylpiperidin-4-yl)thiophene-3-sulfonamide;hydrochloride (PubChem CID 120585748) has the molecular formula C10H15Cl3N2O2S2 and a molecular weight of 365.74 g/mol. Its IUPAC name is 2,5-dichloro-N-(2-methylpiperidin-4-yl)thiophene-3-sulfonamide;hydrochloride.

Molecular Properties

Compound Name2,5-dichloro-N-(2-methylpiperidin-4-yl)thiophene-3-sulfonamide;hydrochloride
PubChem CID120585748
Molecular FormulaC10H15Cl3N2O2S2
Molecular Weight365.74 g/mol
Exact Mass363.96
IUPAC Name2,5-dichloro-N-(2-methylpiperidin-4-yl)thiophene-3-sulfonamide;hydrochloride
SMILESCC1CC(NS(=O)(=O)c2cc(Cl)sc2Cl)CCN1.Cl
InChIInChI=1S/C10H14Cl2N2O2S2.ClH/c1-6-4-7(2-3-13-6)14-18(15,16)8-5-9(11)17-10(8)12;/h5-7,13-14H,2-4H2,1H3;1H
InChIKeyKBVQNYWAYSSPIW-UHFFFAOYSA-N
XLogP2.90
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.74
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2,5-dimethyl-N-(2-methylpiperidin-4-yl)thiophene-3-sulfonamide
CID 106995677
2,5-dichloro-N-piperidin-3-ylthiophene-3-sulfonamide;hydrochloride
CID 119964259
N-(2-methylpiperidin-4-yl)-2-methylsulfanylbenzenesulfonamide
CID 120713766
5-chloro-N-(2-methylpiperidin-4-yl)-2-nitrobenzenesulfonamide
CID 120585645
2-fluoro-4-methyl-N-(2-methylpiperidin-4-yl)benzenesulfonamide;hydrochloride
CID 120585737
2,3,5,6-tetramethyl-N-(2-methylpiperidin-4-yl)benzenesulfonamide;hydrochloride
CID 120586042
4-bromo-3-chloro-N-(2-methylpiperidin-4-yl)benzenesulfonamide;hydrochloride
CID 120586097
2-bromo-5-chloro-4-methoxy-N-(2-methylpiperidin-4-yl)benzenesulfonamide
CID 120585984
2-fluoro-5-methyl-N-(2-methylpiperidin-4-yl)benzenesulfonamide
CID 106995674
2,5-dimethoxy-N-(2-methylpiperidin-4-yl)benzenesulfonamide;hydrochloride
CID 120586052
2,5-dichloro-N-(pyrrolidin-2-ylmethyl)thiophene-3-sulfonamide;hydrochloride
CID 119974225
4-fluoro-3,5-dimethyl-N-(2-methylpiperidin-4-yl)benzenesulfonamide;hydrochloride
CID 120586103

Frequently Asked Questions

What is the IUPAC name of 2,5-dichloro-N-(2-methylpiperidin-4-yl)thiophene-3-sulfonamide;hydrochloride?
The IUPAC name of 2,5-dichloro-N-(2-methylpiperidin-4-yl)thiophene-3-sulfonamide;hydrochloride (CID 120585748) is 2,5-dichloro-N-(2-methylpiperidin-4-yl)thiophene-3-sulfonamide;hydrochloride.
What is the SMILES notation for 2,5-dichloro-N-(2-methylpiperidin-4-yl)thiophene-3-sulfonamide;hydrochloride?
The canonical SMILES for 2,5-dichloro-N-(2-methylpiperidin-4-yl)thiophene-3-sulfonamide;hydrochloride is CC1CC(NS(=O)(=O)c2cc(Cl)sc2Cl)CCN1.Cl.
What is the InChIKey of 2,5-dichloro-N-(2-methylpiperidin-4-yl)thiophene-3-sulfonamide;hydrochloride?
The InChIKey is KBVQNYWAYSSPIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14Cl2N2O2S2.ClH/c1-6-4-7(2-3-13-6)14-18(15,16)8-5-9(11)17-10(8)12;/h5-7,13-14H,2-4H2,1H3;1H.
What are the key properties of 2,5-dichloro-N-(2-methylpiperidin-4-yl)thiophene-3-sulfonamide;hydrochloride?
2,5-dichloro-N-(2-methylpiperidin-4-yl)thiophene-3-sulfonamide;hydrochloride has a molecular weight of 365.74 g/mol, XLogP of 2.90, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dichloro-N-(2-methylpiperidin-4-yl)thiophene-3-sulfonamide;hydrochloride is sourced from PubChem (CID 120585748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).