2-(carboxymethoxy)-2-(pyridin-2-ylamino)acetic acid

C9H10N2O5 — CID 69470783

IUPAC2-(carboxymethoxy)-2-(pyridin-2-ylamino)acetic acid
SMILESO=C(O)COC(Nc1ccccn1)C(=O)O
InChIInChI=1S/C9H10N2O5/c12-7(13)5-16-8(9(14)15)11-6-3-1-2-4-10-6/h1-4,8H,5H2,(H,10,11)(H,12,13)(H,14,15)
InChIKeyHWKFPEVEGMGYDO-UHFFFAOYSA-N
MW226.19 g/mol
LogP0.01
Rot. Bonds6

About 2-(carboxymethoxy)-2-(pyridin-2-ylamino)acetic acid

2-(carboxymethoxy)-2-(pyridin-2-ylamino)acetic acid (PubChem CID 69470783) has the molecular formula C9H10N2O5 and a molecular weight of 226.19 g/mol. Its IUPAC name is 2-(carboxymethoxy)-2-(pyridin-2-ylamino)acetic acid.

Molecular Properties

Compound Name2-(carboxymethoxy)-2-(pyridin-2-ylamino)acetic acid
PubChem CID69470783
Molecular FormulaC9H10N2O5
Molecular Weight226.19 g/mol
Exact Mass226.06
IUPAC Name2-(carboxymethoxy)-2-(pyridin-2-ylamino)acetic acid
SMILESO=C(O)COC(Nc1ccccn1)C(=O)O
InChIInChI=1S/C9H10N2O5/c12-7(13)5-16-8(9(14)15)11-6-3-1-2-4-10-6/h1-4,8H,5H2,(H,10,11)(H,12,13)(H,14,15)
InChIKeyHWKFPEVEGMGYDO-UHFFFAOYSA-N
XLogP0.01
TPSA108.75 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.19
LogP ≤ 50.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

2-[2-oxo-2-(pyridin-2-ylamino)ethoxy]acetic acid
CID 2737830
2-(pyridin-2-ylamino)propanoic acid;hydrate;dihydrochloride
CID 70348749
methyl (2S)-2-phenyl-2-(pyridin-2-ylamino)acetate
CID 102268915
(2S)-2-[2-oxo-2-(2-pyridin-2-ylhydrazinyl)ethoxy]propanoic acid
CID 104876174
(2R,3S)-2-amino-3-(pyridin-2-ylamino)butanoic acid
CID 118492943
methyl 3-hydroxy-2-(pyridin-2-ylamino)propanoate
CID 62005676
3-(pyridin-2-ylamino)hexanoic acid
CID 121217127
2-[4-(pyridin-2-ylsulfamoyl)phenoxy]acetic acid
CID 43132249
diethyl 2-(pyridin-2-ylamino)butanedioate
CID 177223404
2-amino-4-oxo-4-(pyridin-2-ylamino)butanoic acid
CID 115180971
(2R)-2-amino-3-pyridin-2-ylpropanoic acid;(2S)-2-(pyridin-2-ylamino)propanoic acid
CID 67254452
tert-butyl (2R)-3-phenyl-2-(pyridin-2-ylamino)propanoate
CID 132549421

Frequently Asked Questions

What is the IUPAC name of 2-(carboxymethoxy)-2-(pyridin-2-ylamino)acetic acid?
The IUPAC name of 2-(carboxymethoxy)-2-(pyridin-2-ylamino)acetic acid (CID 69470783) is 2-(carboxymethoxy)-2-(pyridin-2-ylamino)acetic acid.
What is the SMILES notation for 2-(carboxymethoxy)-2-(pyridin-2-ylamino)acetic acid?
The canonical SMILES for 2-(carboxymethoxy)-2-(pyridin-2-ylamino)acetic acid is O=C(O)COC(Nc1ccccn1)C(=O)O.
What is the InChIKey of 2-(carboxymethoxy)-2-(pyridin-2-ylamino)acetic acid?
The InChIKey is HWKFPEVEGMGYDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O5/c12-7(13)5-16-8(9(14)15)11-6-3-1-2-4-10-6/h1-4,8H,5H2,(H,10,11)(H,12,13)(H,14,15).
What are the key properties of 2-(carboxymethoxy)-2-(pyridin-2-ylamino)acetic acid?
2-(carboxymethoxy)-2-(pyridin-2-ylamino)acetic acid has a molecular weight of 226.19 g/mol, XLogP of 0.01, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(carboxymethoxy)-2-(pyridin-2-ylamino)acetic acid is sourced from PubChem (CID 69470783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).