6-amino-5-chloro-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-sulfonamide

C12H14ClN3O2S2 — CID 64602655

IUPAC6-amino-5-chloro-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-sulfonamide
SMILESCC(Cc1ccsc1)NS(=O)(=O)c1cnc(N)c(Cl)c1
InChIInChI=1S/C12H14ClN3O2S2/c1-8(4-9-2-3-19-7-9)16-20(17,18)10-5-11(13)12(14)15-6-10/h2-3,5-8,16H,4H2,1H3,(H2,14,15)
InChIKeyGGQUXNZYWSUNJN-UHFFFAOYSA-N
MW331.85 g/mol
LogP2.29
Rot. Bonds5

About 6-amino-5-chloro-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-sulfonamide

6-amino-5-chloro-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-sulfonamide (PubChem CID 64602655) has the molecular formula C12H14ClN3O2S2 and a molecular weight of 331.85 g/mol. Its IUPAC name is 6-amino-5-chloro-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-amino-5-chloro-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-sulfonamide
PubChem CID64602655
Molecular FormulaC12H14ClN3O2S2
Molecular Weight331.85 g/mol
Exact Mass331.02
IUPAC Name6-amino-5-chloro-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-sulfonamide
SMILESCC(Cc1ccsc1)NS(=O)(=O)c1cnc(N)c(Cl)c1
InChIInChI=1S/C12H14ClN3O2S2/c1-8(4-9-2-3-19-7-9)16-20(17,18)10-5-11(13)12(14)15-6-10/h2-3,5-8,16H,4H2,1H3,(H2,14,15)
InChIKeyGGQUXNZYWSUNJN-UHFFFAOYSA-N
XLogP2.29
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.85
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-5-chloro-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide
CID 61474983
5-bromo-2-chloro-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-sulfonamide
CID 61223337
4-bromo-2,6-dichloro-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide
CID 63420478
6-amino-5-chloro-N-(2-methylpropyl)pyridine-3-sulfonamide
CID 64607743
4-amino-3-methoxy-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide
CID 81440427
3-amino-N-(1-thiophen-3-ylpropan-2-yl)pyridine-2-sulfonamide
CID 103305478
4-(bromomethyl)-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide
CID 65479835
5-amino-2-methyl-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide
CID 61474831
5-methyl-N-(1-thiophen-3-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide
CID 54954014
3-amino-1-ethyl-N-(1-thiophen-3-ylpropan-2-yl)pyrazole-4-sulfonamide
CID 61474909
6-amino-5-chloro-N-(1-cyclopropylethyl)pyridine-3-sulfonamide
CID 64609097
6-amino-N-[1-(4-bromophenyl)ethyl]-5-chloropyridine-3-sulfonamide
CID 64601294

Frequently Asked Questions

What is the IUPAC name of 6-amino-5-chloro-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-sulfonamide?
The IUPAC name of 6-amino-5-chloro-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-sulfonamide (CID 64602655) is 6-amino-5-chloro-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-sulfonamide.
What is the SMILES notation for 6-amino-5-chloro-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-sulfonamide?
The canonical SMILES for 6-amino-5-chloro-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-sulfonamide is CC(Cc1ccsc1)NS(=O)(=O)c1cnc(N)c(Cl)c1.
What is the InChIKey of 6-amino-5-chloro-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-sulfonamide?
The InChIKey is GGQUXNZYWSUNJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14ClN3O2S2/c1-8(4-9-2-3-19-7-9)16-20(17,18)10-5-11(13)12(14)15-6-10/h2-3,5-8,16H,4H2,1H3,(H2,14,15).
What are the key properties of 6-amino-5-chloro-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-sulfonamide?
6-amino-5-chloro-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-sulfonamide has a molecular weight of 331.85 g/mol, XLogP of 2.29, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-5-chloro-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-sulfonamide is sourced from PubChem (CID 64602655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).