2-[(5-amino-6-ethoxy-2-pyridinyl)amino]ethanesulfonamide

C9H16N4O3S — CID 43551624

IUPAC2-[(5-amino-6-ethoxy-2-pyridinyl)amino]ethanesulfonamide
SMILESCCOc1nc(NCCS(N)(=O)=O)ccc1N
InChIInChI=1S/C9H16N4O3S/c1-2-16-9-7(10)3-4-8(13-9)12-5-6-17(11,14)15/h3-4H,2,5-6,10H2,1H3,(H,12,13)(H2,11,14,15)
InChIKeyPRPQBAVQMGBRHZ-UHFFFAOYSA-N
MW260.32 g/mol
LogP-0.24
Rot. Bonds6

About 2-[(5-amino-6-ethoxy-2-pyridinyl)amino]ethanesulfonamide

2-[(5-amino-6-ethoxy-2-pyridinyl)amino]ethanesulfonamide (PubChem CID 43551624) has the molecular formula C9H16N4O3S and a molecular weight of 260.32 g/mol. Its IUPAC name is 2-[(5-amino-6-ethoxy-2-pyridinyl)amino]ethanesulfonamide.

Molecular Properties

Compound Name2-[(5-amino-6-ethoxy-2-pyridinyl)amino]ethanesulfonamide
PubChem CID43551624
Molecular FormulaC9H16N4O3S
Molecular Weight260.32 g/mol
Exact Mass260.09
IUPAC Name2-[(5-amino-6-ethoxy-2-pyridinyl)amino]ethanesulfonamide
SMILESCCOc1nc(NCCS(N)(=O)=O)ccc1N
InChIInChI=1S/C9H16N4O3S/c1-2-16-9-7(10)3-4-8(13-9)12-5-6-17(11,14)15/h3-4H,2,5-6,10H2,1H3,(H,12,13)(H2,11,14,15)
InChIKeyPRPQBAVQMGBRHZ-UHFFFAOYSA-N
XLogP-0.24
TPSA120.33 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.32
LogP ≤ 5-0.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[(5-amino-6-ethoxy-2-pyridinyl)amino]ethanesulfonamide?
The IUPAC name of 2-[(5-amino-6-ethoxy-2-pyridinyl)amino]ethanesulfonamide (CID 43551624) is 2-[(5-amino-6-ethoxy-2-pyridinyl)amino]ethanesulfonamide.
What is the SMILES notation for 2-[(5-amino-6-ethoxy-2-pyridinyl)amino]ethanesulfonamide?
The canonical SMILES for 2-[(5-amino-6-ethoxy-2-pyridinyl)amino]ethanesulfonamide is CCOc1nc(NCCS(N)(=O)=O)ccc1N.
What is the InChIKey of 2-[(5-amino-6-ethoxy-2-pyridinyl)amino]ethanesulfonamide?
The InChIKey is PRPQBAVQMGBRHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4O3S/c1-2-16-9-7(10)3-4-8(13-9)12-5-6-17(11,14)15/h3-4H,2,5-6,10H2,1H3,(H,12,13)(H2,11,14,15).
What are the key properties of 2-[(5-amino-6-ethoxy-2-pyridinyl)amino]ethanesulfonamide?
2-[(5-amino-6-ethoxy-2-pyridinyl)amino]ethanesulfonamide has a molecular weight of 260.32 g/mol, XLogP of -0.24, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-amino-6-ethoxy-2-pyridinyl)amino]ethanesulfonamide is sourced from PubChem (CID 43551624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).