methyl 2-(pyridin-2-ylamino)acetate

C8H10N2O2 — CID 14585555

IUPACmethyl 2-(pyridin-2-ylamino)acetate
SMILESCOC(=O)CNc1ccccn1
InChIInChI=1S/C8H10N2O2/c1-12-8(11)6-10-7-4-2-3-5-9-7/h2-5H,6H2,1H3,(H,9,10)
InChIKeyIROXMQZTWZZQLR-UHFFFAOYSA-N
MW166.18 g/mol
LogP0.67
Rot. Bonds3

About methyl 2-(pyridin-2-ylamino)acetate

methyl 2-(pyridin-2-ylamino)acetate (PubChem CID 14585555) has the molecular formula C8H10N2O2 and a molecular weight of 166.18 g/mol. Its IUPAC name is methyl 2-(pyridin-2-ylamino)acetate.

Molecular Properties

Compound Namemethyl 2-(pyridin-2-ylamino)acetate
PubChem CID14585555
Molecular FormulaC8H10N2O2
Molecular Weight166.18 g/mol
Exact Mass166.07
IUPAC Namemethyl 2-(pyridin-2-ylamino)acetate
SMILESCOC(=O)CNc1ccccn1
InChIInChI=1S/C8H10N2O2/c1-12-8(11)6-10-7-4-2-3-5-9-7/h2-5H,6H2,1H3,(H,9,10)
InChIKeyIROXMQZTWZZQLR-UHFFFAOYSA-N
XLogP0.67
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.18
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of methyl 2-(pyridin-2-ylamino)acetate?
The IUPAC name of methyl 2-(pyridin-2-ylamino)acetate (CID 14585555) is methyl 2-(pyridin-2-ylamino)acetate.
What is the SMILES notation for methyl 2-(pyridin-2-ylamino)acetate?
The canonical SMILES for methyl 2-(pyridin-2-ylamino)acetate is COC(=O)CNc1ccccn1.
What is the InChIKey of methyl 2-(pyridin-2-ylamino)acetate?
The InChIKey is IROXMQZTWZZQLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O2/c1-12-8(11)6-10-7-4-2-3-5-9-7/h2-5H,6H2,1H3,(H,9,10).
What are the key properties of methyl 2-(pyridin-2-ylamino)acetate?
methyl 2-(pyridin-2-ylamino)acetate has a molecular weight of 166.18 g/mol, XLogP of 0.67, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(pyridin-2-ylamino)acetate is sourced from PubChem (CID 14585555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).