2-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)pyridine-4-sulfonamide

C11H12N4O2S2 — CID 62158122

IUPAC2-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)pyridine-4-sulfonamide
SMILESNc1cc(S(=O)(=O)Nc2nc(C3CC3)cs2)ccn1
InChIInChI=1S/C11H12N4O2S2/c12-10-5-8(3-4-13-10)19(16,17)15-11-14-9(6-18-11)7-1-2-7/h3-7H,1-2H2,(H2,12,13)(H,14,15)
InChIKeyMFDXVYPRMUCVLR-UHFFFAOYSA-N
MW296.38 g/mol
LogP1.80
Rot. Bonds4

About 2-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)pyridine-4-sulfonamide

2-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)pyridine-4-sulfonamide (PubChem CID 62158122) has the molecular formula C11H12N4O2S2 and a molecular weight of 296.38 g/mol. Its IUPAC name is 2-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)pyridine-4-sulfonamide.

Molecular Properties

Compound Name2-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)pyridine-4-sulfonamide
PubChem CID62158122
Molecular FormulaC11H12N4O2S2
Molecular Weight296.38 g/mol
Exact Mass296.04
IUPAC Name2-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)pyridine-4-sulfonamide
SMILESNc1cc(S(=O)(=O)Nc2nc(C3CC3)cs2)ccn1
InChIInChI=1S/C11H12N4O2S2/c12-10-5-8(3-4-13-10)19(16,17)15-11-14-9(6-18-11)7-1-2-7/h3-7H,1-2H2,(H2,12,13)(H,14,15)
InChIKeyMFDXVYPRMUCVLR-UHFFFAOYSA-N
XLogP1.80
TPSA97.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.38
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)pyridine-4-sulfonamide?
The IUPAC name of 2-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)pyridine-4-sulfonamide (CID 62158122) is 2-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)pyridine-4-sulfonamide.
What is the SMILES notation for 2-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)pyridine-4-sulfonamide?
The canonical SMILES for 2-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)pyridine-4-sulfonamide is Nc1cc(S(=O)(=O)Nc2nc(C3CC3)cs2)ccn1.
What is the InChIKey of 2-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)pyridine-4-sulfonamide?
The InChIKey is MFDXVYPRMUCVLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O2S2/c12-10-5-8(3-4-13-10)19(16,17)15-11-14-9(6-18-11)7-1-2-7/h3-7H,1-2H2,(H2,12,13)(H,14,15).
What are the key properties of 2-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)pyridine-4-sulfonamide?
2-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)pyridine-4-sulfonamide has a molecular weight of 296.38 g/mol, XLogP of 1.80, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(4-cyclopropyl-1,3-thiazol-2-yl)pyridine-4-sulfonamide is sourced from PubChem (CID 62158122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).