5-chloro-4-methyl-N-(2-piperidin-3-ylethyl)thiophene-2-sulfonamide;hydrochloride

C12H20Cl2N2O2S2 — CID 120710051

IUPAC5-chloro-4-methyl-N-(2-piperidin-3-ylethyl)thiophene-2-sulfonamide;hydrochloride
SMILESCc1cc(S(=O)(=O)NCCC2CCCNC2)sc1Cl.Cl
InChIInChI=1S/C12H19ClN2O2S2.ClH/c1-9-7-11(18-12(9)13)19(16,17)15-6-4-10-3-2-5-14-8-10;/h7,10,14-15H,2-6,8H2,1H3;1H
InChIKeyQFRJNXHKDYCDCU-UHFFFAOYSA-N
MW359.34 g/mol
LogP2.80
Rot. Bonds5

About 5-chloro-4-methyl-N-(2-piperidin-3-ylethyl)thiophene-2-sulfonamide;hydrochloride

5-chloro-4-methyl-N-(2-piperidin-3-ylethyl)thiophene-2-sulfonamide;hydrochloride (PubChem CID 120710051) has the molecular formula C12H20Cl2N2O2S2 and a molecular weight of 359.34 g/mol. Its IUPAC name is 5-chloro-4-methyl-N-(2-piperidin-3-ylethyl)thiophene-2-sulfonamide;hydrochloride.

Molecular Properties

Compound Name5-chloro-4-methyl-N-(2-piperidin-3-ylethyl)thiophene-2-sulfonamide;hydrochloride
PubChem CID120710051
Molecular FormulaC12H20Cl2N2O2S2
Molecular Weight359.34 g/mol
Exact Mass358.03
IUPAC Name5-chloro-4-methyl-N-(2-piperidin-3-ylethyl)thiophene-2-sulfonamide;hydrochloride
SMILESCc1cc(S(=O)(=O)NCCC2CCCNC2)sc1Cl.Cl
InChIInChI=1S/C12H19ClN2O2S2.ClH/c1-9-7-11(18-12(9)13)19(16,17)15-6-4-10-3-2-5-14-8-10;/h7,10,14-15H,2-6,8H2,1H3;1H
InChIKeyQFRJNXHKDYCDCU-UHFFFAOYSA-N
XLogP2.80
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.34
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2,5-dichloro-N-(2-piperidin-3-ylethyl)thiophene-3-sulfonamide;hydrochloride
CID 119979396
2,5-dichloro-N-(2-piperidin-3-ylethyl)thiophene-3-sulfonamide
CID 55249577
5-chloro-4-methyl-N-(pyrrolidin-3-ylmethyl)thiophene-2-sulfonamide;hydrochloride
CID 120721094
4-chloro-2-methyl-N-(2-piperidin-3-ylethyl)benzenesulfonamide;hydrochloride
CID 119979704
5-chloro-N,4-dimethyl-N-(piperidin-3-ylmethyl)thiophene-2-sulfonamide
CID 106630812
5-chloro-4-methyl-N-(piperidin-4-ylmethyl)thiophene-2-sulfonamide
CID 103100386
5-chloro-N-ethyl-4-methyl-N-(piperidin-3-ylmethyl)thiophene-2-sulfonamide
CID 106631097
5-chloro-N-cyclopropyl-4-methyl-N-(piperidin-3-ylmethyl)thiophene-2-sulfonamide
CID 106631230
5-chloro-4-methyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylthiophene-2-sulfonamide
CID 106630961
2,5-dibromo-4-methyl-N-(2-piperidin-3-ylethyl)benzenesulfonamide
CID 81319102
5-bromo-2-methyl-N-(2-piperidin-3-ylethyl)benzenesulfonamide
CID 63629233
2,5-dimethyl-3-methylsulfonyl-N-(2-piperidin-3-ylethyl)benzenesulfonamide;hydrochloride
CID 119979725

Frequently Asked Questions

What is the IUPAC name of 5-chloro-4-methyl-N-(2-piperidin-3-ylethyl)thiophene-2-sulfonamide;hydrochloride?
The IUPAC name of 5-chloro-4-methyl-N-(2-piperidin-3-ylethyl)thiophene-2-sulfonamide;hydrochloride (CID 120710051) is 5-chloro-4-methyl-N-(2-piperidin-3-ylethyl)thiophene-2-sulfonamide;hydrochloride.
What is the SMILES notation for 5-chloro-4-methyl-N-(2-piperidin-3-ylethyl)thiophene-2-sulfonamide;hydrochloride?
The canonical SMILES for 5-chloro-4-methyl-N-(2-piperidin-3-ylethyl)thiophene-2-sulfonamide;hydrochloride is Cc1cc(S(=O)(=O)NCCC2CCCNC2)sc1Cl.Cl.
What is the InChIKey of 5-chloro-4-methyl-N-(2-piperidin-3-ylethyl)thiophene-2-sulfonamide;hydrochloride?
The InChIKey is QFRJNXHKDYCDCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19ClN2O2S2.ClH/c1-9-7-11(18-12(9)13)19(16,17)15-6-4-10-3-2-5-14-8-10;/h7,10,14-15H,2-6,8H2,1H3;1H.
What are the key properties of 5-chloro-4-methyl-N-(2-piperidin-3-ylethyl)thiophene-2-sulfonamide;hydrochloride?
5-chloro-4-methyl-N-(2-piperidin-3-ylethyl)thiophene-2-sulfonamide;hydrochloride has a molecular weight of 359.34 g/mol, XLogP of 2.80, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-4-methyl-N-(2-piperidin-3-ylethyl)thiophene-2-sulfonamide;hydrochloride is sourced from PubChem (CID 120710051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).