methyl 2-amino-6-(formamidomethyl)pyridine-3-carboxylate

C9H11N3O3 — CID 156808956

IUPACmethyl 2-amino-6-(formamidomethyl)pyridine-3-carboxylate
SMILESCOC(=O)c1ccc(CNC=O)nc1N
InChIInChI=1S/C9H11N3O3/c1-15-9(14)7-3-2-6(4-11-5-13)12-8(7)10/h2-3,5H,4H2,1H3,(H2,10,12)(H,11,13)
InChIKeyFGFDLBUGYGWQFU-UHFFFAOYSA-N
MW209.21 g/mol
LogP-0.30
Rot. Bonds4

About methyl 2-amino-6-(formamidomethyl)pyridine-3-carboxylate

methyl 2-amino-6-(formamidomethyl)pyridine-3-carboxylate (PubChem CID 156808956) has the molecular formula C9H11N3O3 and a molecular weight of 209.21 g/mol. Its IUPAC name is methyl 2-amino-6-(formamidomethyl)pyridine-3-carboxylate.

Molecular Properties

Compound Namemethyl 2-amino-6-(formamidomethyl)pyridine-3-carboxylate
PubChem CID156808956
Molecular FormulaC9H11N3O3
Molecular Weight209.21 g/mol
Exact Mass209.08
IUPAC Namemethyl 2-amino-6-(formamidomethyl)pyridine-3-carboxylate
SMILESCOC(=O)c1ccc(CNC=O)nc1N
InChIInChI=1S/C9H11N3O3/c1-15-9(14)7-3-2-6(4-11-5-13)12-8(7)10/h2-3,5H,4H2,1H3,(H2,10,12)(H,11,13)
InChIKeyFGFDLBUGYGWQFU-UHFFFAOYSA-N
XLogP-0.30
TPSA94.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.21
LogP ≤ 5-0.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

ethyl 3-bromo-6-(formamidomethyl)pyridine-2-carboxylate
CID 122609586
methyl 2-amino-6-(2,2-difluorobut-3-enoxy)pyridine-3-carboxylate
CID 162607042
methyl 2-amino-8-methylquinoline-3-carboxylate
CID 135393173
methyl 6-bromo-2-formylpyridine-3-carboxylate
CID 112757160
methyl 2-amino-6-(3,3-difluorobutoxy)pyridine-3-carboxylate
CID 154664795
methyl 2-chloro-6-(methylsulfonylmethyl)pyridine-3-carboxylate
CID 150679843
methyl 6-(aminomethyl)-2-propylpyridine-3-carboxylate
CID 71758644
methyl 6-(bromomethyl)-2-chloropyridine-3-carboxylate
CID 21083280
methyl 2-amino-5-bromo-6-chloropyridine-3-carboxylate
CID 131521858
ethyl 2,6-diaminopyridine-3-carboxylate
CID 58784252
methyl 2-amino-6-(4-hydroxypiperidin-1-yl)pyridine-3-carboxylate
CID 142386891
methyl 2-amino-8-fluoroquinoline-3-carboxylate
CID 135392236

Frequently Asked Questions

What is the IUPAC name of methyl 2-amino-6-(formamidomethyl)pyridine-3-carboxylate?
The IUPAC name of methyl 2-amino-6-(formamidomethyl)pyridine-3-carboxylate (CID 156808956) is methyl 2-amino-6-(formamidomethyl)pyridine-3-carboxylate.
What is the SMILES notation for methyl 2-amino-6-(formamidomethyl)pyridine-3-carboxylate?
The canonical SMILES for methyl 2-amino-6-(formamidomethyl)pyridine-3-carboxylate is COC(=O)c1ccc(CNC=O)nc1N.
What is the InChIKey of methyl 2-amino-6-(formamidomethyl)pyridine-3-carboxylate?
The InChIKey is FGFDLBUGYGWQFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O3/c1-15-9(14)7-3-2-6(4-11-5-13)12-8(7)10/h2-3,5H,4H2,1H3,(H2,10,12)(H,11,13).
What are the key properties of methyl 2-amino-6-(formamidomethyl)pyridine-3-carboxylate?
methyl 2-amino-6-(formamidomethyl)pyridine-3-carboxylate has a molecular weight of 209.21 g/mol, XLogP of -0.30, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-amino-6-(formamidomethyl)pyridine-3-carboxylate is sourced from PubChem (CID 156808956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).