2,5-dichloro-N-[3-(2-oxopyrrolidin-1-yl)phenyl]thiophene-3-sulfonamide

C14H12Cl2N2O3S2 — CID 26268476

IUPAC2,5-dichloro-N-[3-(2-oxopyrrolidin-1-yl)phenyl]thiophene-3-sulfonamide
SMILESO=C1CCCN1c1cccc(NS(=O)(=O)c2cc(Cl)sc2Cl)c1
InChIInChI=1S/C14H12Cl2N2O3S2/c15-12-8-11(14(16)22-12)23(20,21)17-9-3-1-4-10(7-9)18-6-2-5-13(18)19/h1,3-4,7-8,17H,2,5-6H2
InChIKeyZGYGMGAJGBHDQM-UHFFFAOYSA-N
MW391.30 g/mol
LogP3.98
Rot. Bonds4

About 2,5-dichloro-N-[3-(2-oxopyrrolidin-1-yl)phenyl]thiophene-3-sulfonamide

2,5-dichloro-N-[3-(2-oxopyrrolidin-1-yl)phenyl]thiophene-3-sulfonamide (PubChem CID 26268476) has the molecular formula C14H12Cl2N2O3S2 and a molecular weight of 391.30 g/mol. Its IUPAC name is 2,5-dichloro-N-[3-(2-oxopyrrolidin-1-yl)phenyl]thiophene-3-sulfonamide.

Molecular Properties

Compound Name2,5-dichloro-N-[3-(2-oxopyrrolidin-1-yl)phenyl]thiophene-3-sulfonamide
PubChem CID26268476
Molecular FormulaC14H12Cl2N2O3S2
Molecular Weight391.30 g/mol
Exact Mass389.97
IUPAC Name2,5-dichloro-N-[3-(2-oxopyrrolidin-1-yl)phenyl]thiophene-3-sulfonamide
SMILESO=C1CCCN1c1cccc(NS(=O)(=O)c2cc(Cl)sc2Cl)c1
InChIInChI=1S/C14H12Cl2N2O3S2/c15-12-8-11(14(16)22-12)23(20,21)17-9-3-1-4-10(7-9)18-6-2-5-13(18)19/h1,3-4,7-8,17H,2,5-6H2
InChIKeyZGYGMGAJGBHDQM-UHFFFAOYSA-N
XLogP3.98
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.30
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,3-dichloro-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzenesulfonamide
CID 8841870
5-chloro-N-[3-(2-oxopiperidin-1-yl)phenyl]thiophene-2-sulfonamide
CID 7636296
2-chloro-N-[3-(2-oxopiperidin-1-yl)phenyl]benzenesulfonamide
CID 7636299
4-chloro-2,5-dimethyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzenesulfonamide
CID 7635926
2,5-dichloro-N-[3-methoxy-4-(2-oxopyrrolidin-1-yl)phenyl]thiophene-3-sulfonamide
CID 17495366
4-chloro-N-[3-(2-oxopiperidin-1-yl)phenyl]benzenesulfonamide
CID 7636285
4-methylsulfanyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzenesulfonamide
CID 49187272
3-methyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzenesulfonamide
CID 7635918
N-[3-(2-oxopyrrolidin-1-yl)phenyl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
CID 7635947
4-methoxy-2,5-dimethyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzenesulfonamide
CID 7635954
N-[3-(2-oxopyrrolidin-1-yl)phenyl]-4-(trifluoromethyl)benzenesulfonamide
CID 8841908
2,5-dimethoxy-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzenesulfonamide
CID 7635928

Frequently Asked Questions

What is the IUPAC name of 2,5-dichloro-N-[3-(2-oxopyrrolidin-1-yl)phenyl]thiophene-3-sulfonamide?
The IUPAC name of 2,5-dichloro-N-[3-(2-oxopyrrolidin-1-yl)phenyl]thiophene-3-sulfonamide (CID 26268476) is 2,5-dichloro-N-[3-(2-oxopyrrolidin-1-yl)phenyl]thiophene-3-sulfonamide.
What is the SMILES notation for 2,5-dichloro-N-[3-(2-oxopyrrolidin-1-yl)phenyl]thiophene-3-sulfonamide?
The canonical SMILES for 2,5-dichloro-N-[3-(2-oxopyrrolidin-1-yl)phenyl]thiophene-3-sulfonamide is O=C1CCCN1c1cccc(NS(=O)(=O)c2cc(Cl)sc2Cl)c1.
What is the InChIKey of 2,5-dichloro-N-[3-(2-oxopyrrolidin-1-yl)phenyl]thiophene-3-sulfonamide?
The InChIKey is ZGYGMGAJGBHDQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2N2O3S2/c15-12-8-11(14(16)22-12)23(20,21)17-9-3-1-4-10(7-9)18-6-2-5-13(18)19/h1,3-4,7-8,17H,2,5-6H2.
What are the key properties of 2,5-dichloro-N-[3-(2-oxopyrrolidin-1-yl)phenyl]thiophene-3-sulfonamide?
2,5-dichloro-N-[3-(2-oxopyrrolidin-1-yl)phenyl]thiophene-3-sulfonamide has a molecular weight of 391.30 g/mol, XLogP of 3.98, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dichloro-N-[3-(2-oxopyrrolidin-1-yl)phenyl]thiophene-3-sulfonamide is sourced from PubChem (CID 26268476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).