4-(morpholin-4-ylamino)pyridine-3-sulfonamide

C9H14N4O3S — CID 12554648

IUPAC4-(morpholin-4-ylamino)pyridine-3-sulfonamide
SMILESNS(=O)(=O)c1cnccc1NN1CCOCC1
InChIInChI=1S/C9H14N4O3S/c10-17(14,15)9-7-11-2-1-8(9)12-13-3-5-16-6-4-13/h1-2,7H,3-6H2,(H,11,12)(H2,10,14,15)
InChIKeyLAHLOAAMQFFOJJ-UHFFFAOYSA-N
MW258.30 g/mol
LogP-0.61
Rot. Bonds3

About 4-(morpholin-4-ylamino)pyridine-3-sulfonamide

4-(morpholin-4-ylamino)pyridine-3-sulfonamide (PubChem CID 12554648) has the molecular formula C9H14N4O3S and a molecular weight of 258.30 g/mol. Its IUPAC name is 4-(morpholin-4-ylamino)pyridine-3-sulfonamide.

Molecular Properties

Compound Name4-(morpholin-4-ylamino)pyridine-3-sulfonamide
PubChem CID12554648
Molecular FormulaC9H14N4O3S
Molecular Weight258.30 g/mol
Exact Mass258.08
IUPAC Name4-(morpholin-4-ylamino)pyridine-3-sulfonamide
SMILESNS(=O)(=O)c1cnccc1NN1CCOCC1
InChIInChI=1S/C9H14N4O3S/c10-17(14,15)9-7-11-2-1-8(9)12-13-3-5-16-6-4-13/h1-2,7H,3-6H2,(H,11,12)(H2,10,14,15)
InChIKeyLAHLOAAMQFFOJJ-UHFFFAOYSA-N
XLogP-0.61
TPSA97.55 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.30
LogP ≤ 5-0.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(morpholin-4-ylamino)pyridine-3-sulfonamide?
The IUPAC name of 4-(morpholin-4-ylamino)pyridine-3-sulfonamide (CID 12554648) is 4-(morpholin-4-ylamino)pyridine-3-sulfonamide.
What is the SMILES notation for 4-(morpholin-4-ylamino)pyridine-3-sulfonamide?
The canonical SMILES for 4-(morpholin-4-ylamino)pyridine-3-sulfonamide is NS(=O)(=O)c1cnccc1NN1CCOCC1.
What is the InChIKey of 4-(morpholin-4-ylamino)pyridine-3-sulfonamide?
The InChIKey is LAHLOAAMQFFOJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O3S/c10-17(14,15)9-7-11-2-1-8(9)12-13-3-5-16-6-4-13/h1-2,7H,3-6H2,(H,11,12)(H2,10,14,15).
What are the key properties of 4-(morpholin-4-ylamino)pyridine-3-sulfonamide?
4-(morpholin-4-ylamino)pyridine-3-sulfonamide has a molecular weight of 258.30 g/mol, XLogP of -0.61, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(morpholin-4-ylamino)pyridine-3-sulfonamide is sourced from PubChem (CID 12554648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).