5-[(5-chlorothiophen-2-yl)sulfonylamino]pyridine-3-carboxylic acid

C10H7ClN2O4S2 — CID 5263595

IUPAC5-[(5-chlorothiophen-2-yl)sulfonylamino]pyridine-3-carboxylic acid
SMILESO=C(O)c1cncc(NS(=O)(=O)c2ccc(Cl)s2)c1
InChIInChI=1S/C10H7ClN2O4S2/c11-8-1-2-9(18-8)19(16,17)13-7-3-6(10(14)15)4-12-5-7/h1-5,13H,(H,14,15)
InChIKeyRTRGLVCDCPAMRR-UHFFFAOYSA-N
MW318.76 g/mol
LogP2.30
Rot. Bonds4

About 5-[(5-chlorothiophen-2-yl)sulfonylamino]pyridine-3-carboxylic acid

5-[(5-chlorothiophen-2-yl)sulfonylamino]pyridine-3-carboxylic acid (PubChem CID 5263595) has the molecular formula C10H7ClN2O4S2 and a molecular weight of 318.76 g/mol. Its IUPAC name is 5-[(5-chlorothiophen-2-yl)sulfonylamino]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name5-[(5-chlorothiophen-2-yl)sulfonylamino]pyridine-3-carboxylic acid
PubChem CID5263595
Molecular FormulaC10H7ClN2O4S2
Molecular Weight318.76 g/mol
Exact Mass317.95
IUPAC Name5-[(5-chlorothiophen-2-yl)sulfonylamino]pyridine-3-carboxylic acid
SMILESO=C(O)c1cncc(NS(=O)(=O)c2ccc(Cl)s2)c1
InChIInChI=1S/C10H7ClN2O4S2/c11-8-1-2-9(18-8)19(16,17)13-7-3-6(10(14)15)4-12-5-7/h1-5,13H,(H,14,15)
InChIKeyRTRGLVCDCPAMRR-UHFFFAOYSA-N
XLogP2.30
TPSA96.36 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.76
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-bromo-3-[(5-chlorothiophen-2-yl)sulfonylamino]benzoic acid
CID 103866901
5-[(5-chlorothiophen-2-yl)sulfonylamino]-2-pyrrolidin-1-ylpyridine-3-carboxylic acid
CID 53024698
2-(azepan-1-yl)-5-[(5-chlorothiophen-2-yl)sulfonylamino]pyridine-3-carboxylic acid
CID 53024673
4-[(5-chlorothiophen-2-yl)sulfonylamino]benzoate
CID 7040231
N-(5-bromo-6-chloro-3-pyridinyl)-5-chlorothiophene-2-sulfonamide
CID 104826704
5-[(5-chlorothiophen-2-yl)sulfonylamino]-2-pyrrolidin-1-ylpyridine-3-carboxylic acid;2,2,2-trifluoroacetic acid
CID 146054547
5-[(5-chlorothiophen-2-yl)sulfonylamino]-2-morpholin-4-ylpyridine-3-carboxylic acid;2,2,2-trifluoroacetic acid
CID 146054749
5-(methylsulfonylmethylsulfonylamino)pyridine-3-carboxylic acid
CID 82838842
2-[bis(2-methylpropyl)amino]-5-[(5-chlorothiophen-2-yl)sulfonylamino]pyridine-3-carboxylic acid;2,2,2-trifluoroacetic acid
CID 146054625
3-[(5-chlorothiophen-2-yl)sulfonylamino]thiophene-2-carboxylic acid
CID 43443028
N-(6-amino-3-pyridinyl)-5-chlorothiophene-2-sulfonamide
CID 55025745
5-chloro-N-[4-(trifluoromethylsulfonyl)phenyl]thiophene-2-sulfonamide
CID 166200870

Frequently Asked Questions

What is the IUPAC name of 5-[(5-chlorothiophen-2-yl)sulfonylamino]pyridine-3-carboxylic acid?
The IUPAC name of 5-[(5-chlorothiophen-2-yl)sulfonylamino]pyridine-3-carboxylic acid (CID 5263595) is 5-[(5-chlorothiophen-2-yl)sulfonylamino]pyridine-3-carboxylic acid.
What is the SMILES notation for 5-[(5-chlorothiophen-2-yl)sulfonylamino]pyridine-3-carboxylic acid?
The canonical SMILES for 5-[(5-chlorothiophen-2-yl)sulfonylamino]pyridine-3-carboxylic acid is O=C(O)c1cncc(NS(=O)(=O)c2ccc(Cl)s2)c1.
What is the InChIKey of 5-[(5-chlorothiophen-2-yl)sulfonylamino]pyridine-3-carboxylic acid?
The InChIKey is RTRGLVCDCPAMRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7ClN2O4S2/c11-8-1-2-9(18-8)19(16,17)13-7-3-6(10(14)15)4-12-5-7/h1-5,13H,(H,14,15).
What are the key properties of 5-[(5-chlorothiophen-2-yl)sulfonylamino]pyridine-3-carboxylic acid?
5-[(5-chlorothiophen-2-yl)sulfonylamino]pyridine-3-carboxylic acid has a molecular weight of 318.76 g/mol, XLogP of 2.30, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(5-chlorothiophen-2-yl)sulfonylamino]pyridine-3-carboxylic acid is sourced from PubChem (CID 5263595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).