2-[(5-amino-6-methoxy-2-pyridinyl)amino]-N-ethylethanesulfonamide

C10H18N4O3S — CID 106334265

IUPAC2-[(5-amino-6-methoxy-2-pyridinyl)amino]-N-ethylethanesulfonamide
SMILESCCNS(=O)(=O)CCNc1ccc(N)c(OC)n1
InChIInChI=1S/C10H18N4O3S/c1-3-13-18(15,16)7-6-12-9-5-4-8(11)10(14-9)17-2/h4-5,13H,3,6-7,11H2,1-2H3,(H,12,14)
InChIKeyUUUVCTVZRYEKIO-UHFFFAOYSA-N
MW274.35 g/mol
LogP0.02
Rot. Bonds7

About 2-[(5-amino-6-methoxy-2-pyridinyl)amino]-N-ethylethanesulfonamide

2-[(5-amino-6-methoxy-2-pyridinyl)amino]-N-ethylethanesulfonamide (PubChem CID 106334265) has the molecular formula C10H18N4O3S and a molecular weight of 274.35 g/mol. Its IUPAC name is 2-[(5-amino-6-methoxy-2-pyridinyl)amino]-N-ethylethanesulfonamide.

Molecular Properties

Compound Name2-[(5-amino-6-methoxy-2-pyridinyl)amino]-N-ethylethanesulfonamide
PubChem CID106334265
Molecular FormulaC10H18N4O3S
Molecular Weight274.35 g/mol
Exact Mass274.11
IUPAC Name2-[(5-amino-6-methoxy-2-pyridinyl)amino]-N-ethylethanesulfonamide
SMILESCCNS(=O)(=O)CCNc1ccc(N)c(OC)n1
InChIInChI=1S/C10H18N4O3S/c1-3-13-18(15,16)7-6-12-9-5-4-8(11)10(14-9)17-2/h4-5,13H,3,6-7,11H2,1-2H3,(H,12,14)
InChIKeyUUUVCTVZRYEKIO-UHFFFAOYSA-N
XLogP0.02
TPSA106.34 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.35
LogP ≤ 50.02
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-methoxy-2-pyridinyl)amino]-N-ethylethanesulfonamide?
The IUPAC name of 2-[(5-amino-6-methoxy-2-pyridinyl)amino]-N-ethylethanesulfonamide (CID 106334265) is 2-[(5-amino-6-methoxy-2-pyridinyl)amino]-N-ethylethanesulfonamide.
What is the SMILES notation for 2-[(5-amino-6-methoxy-2-pyridinyl)amino]-N-ethylethanesulfonamide?
The canonical SMILES for 2-[(5-amino-6-methoxy-2-pyridinyl)amino]-N-ethylethanesulfonamide is CCNS(=O)(=O)CCNc1ccc(N)c(OC)n1.
What is the InChIKey of 2-[(5-amino-6-methoxy-2-pyridinyl)amino]-N-ethylethanesulfonamide?
The InChIKey is UUUVCTVZRYEKIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O3S/c1-3-13-18(15,16)7-6-12-9-5-4-8(11)10(14-9)17-2/h4-5,13H,3,6-7,11H2,1-2H3,(H,12,14).
What are the key properties of 2-[(5-amino-6-methoxy-2-pyridinyl)amino]-N-ethylethanesulfonamide?
2-[(5-amino-6-methoxy-2-pyridinyl)amino]-N-ethylethanesulfonamide has a molecular weight of 274.35 g/mol, XLogP of 0.02, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-amino-6-methoxy-2-pyridinyl)amino]-N-ethylethanesulfonamide is sourced from PubChem (CID 106334265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).