2-[(3-amino-2-pyridinyl)sulfonyl-(2-methoxyethyl)amino]acetic acid

C10H15N3O5S — CID 166400276

IUPAC2-[(3-amino-2-pyridinyl)sulfonyl-(2-methoxyethyl)amino]acetic acid
SMILESCOCCN(CC(=O)O)S(=O)(=O)c1ncccc1N
InChIInChI=1S/C10H15N3O5S/c1-18-6-5-13(7-9(14)15)19(16,17)10-8(11)3-2-4-12-10/h2-4H,5-7,11H2,1H3,(H,14,15)
InChIKeyXUCMEAZXBKBMQF-UHFFFAOYSA-N
MW289.31 g/mol
LogP-0.61
Rot. Bonds7

About 2-[(3-amino-2-pyridinyl)sulfonyl-(2-methoxyethyl)amino]acetic acid

2-[(3-amino-2-pyridinyl)sulfonyl-(2-methoxyethyl)amino]acetic acid (PubChem CID 166400276) has the molecular formula C10H15N3O5S and a molecular weight of 289.31 g/mol. Its IUPAC name is 2-[(3-amino-2-pyridinyl)sulfonyl-(2-methoxyethyl)amino]acetic acid.

Molecular Properties

Compound Name2-[(3-amino-2-pyridinyl)sulfonyl-(2-methoxyethyl)amino]acetic acid
PubChem CID166400276
Molecular FormulaC10H15N3O5S
Molecular Weight289.31 g/mol
Exact Mass289.07
IUPAC Name2-[(3-amino-2-pyridinyl)sulfonyl-(2-methoxyethyl)amino]acetic acid
SMILESCOCCN(CC(=O)O)S(=O)(=O)c1ncccc1N
InChIInChI=1S/C10H15N3O5S/c1-18-6-5-13(7-9(14)15)19(16,17)10-8(11)3-2-4-12-10/h2-4H,5-7,11H2,1H3,(H,14,15)
InChIKeyXUCMEAZXBKBMQF-UHFFFAOYSA-N
XLogP-0.61
TPSA122.82 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.31
LogP ≤ 5-0.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

3-amino-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-sulfonamide
CID 103305073
2-[(2-cyano-3-pyridinyl)sulfonyl-(2-methoxyethyl)amino]acetic acid
CID 106593294
3-amino-N-ethyl-N-(2-ethylbutyl)pyridine-2-sulfonamide
CID 103305216
3-amino-N-(2-methoxyethyl)pyridine-2-sulfonamide
CID 103303676
2-(4-methoxybutylsulfonyl)pyridin-3-amine
CID 104648972
2-[(2-amino-2-oxoethyl)-[(3-fluoro-2-pyridinyl)sulfonyl]amino]acetic acid
CID 107435853
3-amino-N-propyl-N-(2,2,2-trifluoroethyl)pyridine-2-sulfonamide
CID 103305039
3-amino-N,N-bis(cyanomethyl)pyridine-2-sulfonamide
CID 103303071
2-[2-amino-N-(2-methoxyethyl)anilino]acetic acid
CID 63118751
2-amino-N-(2-methoxyethyl)-N-(3-methoxypropyl)benzenesulfonamide
CID 61125699
3-[(3-amino-2-pyridinyl)sulfonylamino]-N-(2-methoxyethyl)propanamide
CID 103307140
3-amino-N-(4-methoxybutyl)pyridine-2-sulfonamide
CID 103305180

Frequently Asked Questions

What is the IUPAC name of 2-[(3-amino-2-pyridinyl)sulfonyl-(2-methoxyethyl)amino]acetic acid?
The IUPAC name of 2-[(3-amino-2-pyridinyl)sulfonyl-(2-methoxyethyl)amino]acetic acid (CID 166400276) is 2-[(3-amino-2-pyridinyl)sulfonyl-(2-methoxyethyl)amino]acetic acid.
What is the SMILES notation for 2-[(3-amino-2-pyridinyl)sulfonyl-(2-methoxyethyl)amino]acetic acid?
The canonical SMILES for 2-[(3-amino-2-pyridinyl)sulfonyl-(2-methoxyethyl)amino]acetic acid is COCCN(CC(=O)O)S(=O)(=O)c1ncccc1N.
What is the InChIKey of 2-[(3-amino-2-pyridinyl)sulfonyl-(2-methoxyethyl)amino]acetic acid?
The InChIKey is XUCMEAZXBKBMQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O5S/c1-18-6-5-13(7-9(14)15)19(16,17)10-8(11)3-2-4-12-10/h2-4H,5-7,11H2,1H3,(H,14,15).
What are the key properties of 2-[(3-amino-2-pyridinyl)sulfonyl-(2-methoxyethyl)amino]acetic acid?
2-[(3-amino-2-pyridinyl)sulfonyl-(2-methoxyethyl)amino]acetic acid has a molecular weight of 289.31 g/mol, XLogP of -0.61, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-amino-2-pyridinyl)sulfonyl-(2-methoxyethyl)amino]acetic acid is sourced from PubChem (CID 166400276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).