ethyl 2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine-7-carboxylate

C10H12N2O3 — CID 131337609

IUPACethyl 2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine-7-carboxylate
SMILESCCOC(=O)c1cnc2c(c1)NCCO2
InChIInChI=1S/C10H12N2O3/c1-2-14-10(13)7-5-8-9(12-6-7)15-4-3-11-8/h5-6,11H,2-4H2,1H3
InChIKeyFGLUBRQCJLLOOV-UHFFFAOYSA-N
MW208.22 g/mol
LogP1.06
Rot. Bonds2

About ethyl 2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine-7-carboxylate

ethyl 2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine-7-carboxylate (PubChem CID 131337609) has the molecular formula C10H12N2O3 and a molecular weight of 208.22 g/mol. Its IUPAC name is ethyl 2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine-7-carboxylate.

Molecular Properties

Compound Nameethyl 2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine-7-carboxylate
PubChem CID131337609
Molecular FormulaC10H12N2O3
Molecular Weight208.22 g/mol
Exact Mass208.08
IUPAC Nameethyl 2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine-7-carboxylate
SMILESCCOC(=O)c1cnc2c(c1)NCCO2
InChIInChI=1S/C10H12N2O3/c1-2-14-10(13)7-5-8-9(12-6-7)15-4-3-11-8/h5-6,11H,2-4H2,1H3
InChIKeyFGLUBRQCJLLOOV-UHFFFAOYSA-N
XLogP1.06
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.22
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 5,6,7,8-tetrahydro-1,5-naphthyridine-3-carboxylate
CID 131559753
2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine-7-carbaldehyde
CID 90105679
ethyl 6-amino-5-iodopyridine-3-carboxylate
CID 67057368
ethyl 5-(aminomethyl)-6-methylpyridine-3-carboxylate
CID 118366162
ethyl 3-bromofuro[2,3-b]pyridine-5-carboxylate
CID 68663627
ethyl 5-hydroxy-6-methylpyridine-3-carboxylate
CID 15619972
ethyl 2-(chloromethyl)furo[2,3-b]pyridine-5-carboxylate
CID 10561989
diethyl 3,5-dihydro-2H-pyrido[2,3-f][1,4]oxazepine-4,8-dicarboxylate
CID 122445494
ethyl 6-(dimethylamino)quinoline-3-carboxylate
CID 150996261
ethyl 7-methoxyquinoline-3-carboxylate;hydrochloride
CID 22326874
ethyl 8-methoxy-1,5-naphthyridine-3-carboxylate
CID 59256763
ethyl 5-hydroxyquinoline-3-carboxylate
CID 135618214

Frequently Asked Questions

What is the IUPAC name of ethyl 2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine-7-carboxylate?
The IUPAC name of ethyl 2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine-7-carboxylate (CID 131337609) is ethyl 2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine-7-carboxylate.
What is the SMILES notation for ethyl 2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine-7-carboxylate?
The canonical SMILES for ethyl 2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine-7-carboxylate is CCOC(=O)c1cnc2c(c1)NCCO2.
What is the InChIKey of ethyl 2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine-7-carboxylate?
The InChIKey is FGLUBRQCJLLOOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O3/c1-2-14-10(13)7-5-8-9(12-6-7)15-4-3-11-8/h5-6,11H,2-4H2,1H3.
What are the key properties of ethyl 2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine-7-carboxylate?
ethyl 2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine-7-carboxylate has a molecular weight of 208.22 g/mol, XLogP of 1.06, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine-7-carboxylate is sourced from PubChem (CID 131337609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).