2-bromo-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-3-ol

C6H7BrN2O2 — CID 125453753

IUPAC2-bromo-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-3-ol
SMILESOc1c(Br)nc2n1CCOC2
InChIInChI=1S/C6H7BrN2O2/c7-5-6(10)9-1-2-11-3-4(9)8-5/h10H,1-3H2
InChIKeyOLOGTSPMQBYMOL-UHFFFAOYSA-N
MW219.04 g/mol
LogP0.88
Rot. Bonds

About 2-bromo-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-3-ol

2-bromo-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-3-ol (PubChem CID 125453753) has the molecular formula C6H7BrN2O2 and a molecular weight of 219.04 g/mol. Its IUPAC name is 2-bromo-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-3-ol.

Molecular Properties

Compound Name2-bromo-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-3-ol
PubChem CID125453753
Molecular FormulaC6H7BrN2O2
Molecular Weight219.04 g/mol
Exact Mass217.97
IUPAC Name2-bromo-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-3-ol
SMILESOc1c(Br)nc2n1CCOC2
InChIInChI=1S/C6H7BrN2O2/c7-5-6(10)9-1-2-11-3-4(9)8-5/h10H,1-3H2
InChIKeyOLOGTSPMQBYMOL-UHFFFAOYSA-N
XLogP0.88
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.04
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,3-dibromo-5H,6H,8H-imidazo(2,1-c)(1,4)oxazine
CID 125424296
2-Bromo-3-ethoxy-5H,6H,8H-imidazo[2,1-c][1,4]oxazine
CID 125453848
2-Bromo-3-methoxy-5H,6H,8H-imidazo[2,1-c][1,4]oxazine
CID 125454518

Frequently Asked Questions

What is the IUPAC name of 2-bromo-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-3-ol?
The IUPAC name of 2-bromo-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-3-ol (CID 125453753) is 2-bromo-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-3-ol.
What is the SMILES notation for 2-bromo-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-3-ol?
The canonical SMILES for 2-bromo-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-3-ol is Oc1c(Br)nc2n1CCOC2.
What is the InChIKey of 2-bromo-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-3-ol?
The InChIKey is OLOGTSPMQBYMOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7BrN2O2/c7-5-6(10)9-1-2-11-3-4(9)8-5/h10H,1-3H2.
What are the key properties of 2-bromo-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-3-ol?
2-bromo-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-3-ol has a molecular weight of 219.04 g/mol, XLogP of 0.88, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-3-ol is sourced from PubChem (CID 125453753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).