2-[(6-amino-2-pyridinyl)amino]-N-methylethanesulfonamide

C8H14N4O2S — CID 106343060

IUPAC2-[(6-amino-2-pyridinyl)amino]-N-methylethanesulfonamide
SMILESCNS(=O)(=O)CCNc1cccc(N)n1
InChIInChI=1S/C8H14N4O2S/c1-10-15(13,14)6-5-11-8-4-2-3-7(9)12-8/h2-4,10H,5-6H2,1H3,(H3,9,11,12)
InChIKeyZNZWSGHIVIXSGM-UHFFFAOYSA-N
MW230.29 g/mol
LogP-0.38
Rot. Bonds5

About 2-[(6-amino-2-pyridinyl)amino]-N-methylethanesulfonamide

2-[(6-amino-2-pyridinyl)amino]-N-methylethanesulfonamide (PubChem CID 106343060) has the molecular formula C8H14N4O2S and a molecular weight of 230.29 g/mol. Its IUPAC name is 2-[(6-amino-2-pyridinyl)amino]-N-methylethanesulfonamide.

Molecular Properties

Compound Name2-[(6-amino-2-pyridinyl)amino]-N-methylethanesulfonamide
PubChem CID106343060
Molecular FormulaC8H14N4O2S
Molecular Weight230.29 g/mol
Exact Mass230.08
IUPAC Name2-[(6-amino-2-pyridinyl)amino]-N-methylethanesulfonamide
SMILESCNS(=O)(=O)CCNc1cccc(N)n1
InChIInChI=1S/C8H14N4O2S/c1-10-15(13,14)6-5-11-8-4-2-3-7(9)12-8/h2-4,10H,5-6H2,1H3,(H3,9,11,12)
InChIKeyZNZWSGHIVIXSGM-UHFFFAOYSA-N
XLogP-0.38
TPSA97.11 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.29
LogP ≤ 5-0.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(6-amino-2-pyridinyl)amino]-N-methylethanesulfonamide?
The IUPAC name of 2-[(6-amino-2-pyridinyl)amino]-N-methylethanesulfonamide (CID 106343060) is 2-[(6-amino-2-pyridinyl)amino]-N-methylethanesulfonamide.
What is the SMILES notation for 2-[(6-amino-2-pyridinyl)amino]-N-methylethanesulfonamide?
The canonical SMILES for 2-[(6-amino-2-pyridinyl)amino]-N-methylethanesulfonamide is CNS(=O)(=O)CCNc1cccc(N)n1.
What is the InChIKey of 2-[(6-amino-2-pyridinyl)amino]-N-methylethanesulfonamide?
The InChIKey is ZNZWSGHIVIXSGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4O2S/c1-10-15(13,14)6-5-11-8-4-2-3-7(9)12-8/h2-4,10H,5-6H2,1H3,(H3,9,11,12).
What are the key properties of 2-[(6-amino-2-pyridinyl)amino]-N-methylethanesulfonamide?
2-[(6-amino-2-pyridinyl)amino]-N-methylethanesulfonamide has a molecular weight of 230.29 g/mol, XLogP of -0.38, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-amino-2-pyridinyl)amino]-N-methylethanesulfonamide is sourced from PubChem (CID 106343060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).