6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine-3-carboxylic acid

C7H8N2O3 — CID 82597604

IUPAC6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine-3-carboxylic acid
SMILESO=C(O)c1cnc2n1CCOC2
InChIInChI=1S/C7H8N2O3/c10-7(11)5-3-8-6-4-12-2-1-9(5)6/h3H,1-2,4H2,(H,10,11)
InChIKeyLUZJTZJJRISIMM-UHFFFAOYSA-N
MW168.15 g/mol
LogP0.11
Rot. Bonds1

About 6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine-3-carboxylic acid

6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine-3-carboxylic acid (PubChem CID 82597604) has the molecular formula C7H8N2O3 and a molecular weight of 168.15 g/mol. Its IUPAC name is 6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine-3-carboxylic acid.

Molecular Properties

Compound Name6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine-3-carboxylic acid
PubChem CID82597604
Molecular FormulaC7H8N2O3
Molecular Weight168.15 g/mol
Exact Mass168.05
IUPAC Name6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine-3-carboxylic acid
SMILESO=C(O)c1cnc2n1CCOC2
InChIInChI=1S/C7H8N2O3/c10-7(11)5-3-8-6-4-12-2-1-9(5)6/h3H,1-2,4H2,(H,10,11)
InChIKeyLUZJTZJJRISIMM-UHFFFAOYSA-N
XLogP0.11
TPSA64.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.15
LogP ≤ 50.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine-3-carboxylic acid?
The IUPAC name of 6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine-3-carboxylic acid (CID 82597604) is 6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine-3-carboxylic acid.
What is the SMILES notation for 6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine-3-carboxylic acid?
The canonical SMILES for 6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine-3-carboxylic acid is O=C(O)c1cnc2n1CCOC2.
What is the InChIKey of 6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine-3-carboxylic acid?
The InChIKey is LUZJTZJJRISIMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2O3/c10-7(11)5-3-8-6-4-12-2-1-9(5)6/h3H,1-2,4H2,(H,10,11).
What are the key properties of 6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine-3-carboxylic acid?
6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine-3-carboxylic acid has a molecular weight of 168.15 g/mol, XLogP of 0.11, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine-3-carboxylic acid is sourced from PubChem (CID 82597604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).