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

C7H9BrN2O2 — CID 125454518

IUPAC2-bromo-3-methoxy-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine
SMILESCOc1c(Br)nc2n1CCOC2
InChIInChI=1S/C7H9BrN2O2/c1-11-7-6(8)9-5-4-12-3-2-10(5)7/h2-4H2,1H3
InChIKeyVRHSQLGNZKMUET-UHFFFAOYSA-N
MW233.06 g/mol
LogP1.18
Rot. Bonds1

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

2-bromo-3-methoxy-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine (PubChem CID 125454518) has the molecular formula C7H9BrN2O2 and a molecular weight of 233.06 g/mol. Its IUPAC name is 2-bromo-3-methoxy-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine.

Molecular Properties

Compound Name2-bromo-3-methoxy-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine
PubChem CID125454518
Molecular FormulaC7H9BrN2O2
Molecular Weight233.06 g/mol
Exact Mass231.98
IUPAC Name2-bromo-3-methoxy-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine
SMILESCOc1c(Br)nc2n1CCOC2
InChIInChI=1S/C7H9BrN2O2/c1-11-7-6(8)9-5-4-12-3-2-10(5)7/h2-4H2,1H3
InChIKeyVRHSQLGNZKMUET-UHFFFAOYSA-N
XLogP1.18
TPSA36.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.06
LogP ≤ 51.18
H-Bond Donors ≤ 50
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-5H,6H,8H-imidazo[2,1-c][1,4]oxazin-3-ol
CID 125453753
2-Bromo-3-ethoxy-5H,6H,8H-imidazo[2,1-c][1,4]oxazine
CID 125453848

Frequently Asked Questions

What is the IUPAC name of 2-bromo-3-methoxy-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine?
The IUPAC name of 2-bromo-3-methoxy-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine (CID 125454518) is 2-bromo-3-methoxy-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine.
What is the SMILES notation for 2-bromo-3-methoxy-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine?
The canonical SMILES for 2-bromo-3-methoxy-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine is COc1c(Br)nc2n1CCOC2.
What is the InChIKey of 2-bromo-3-methoxy-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine?
The InChIKey is VRHSQLGNZKMUET-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9BrN2O2/c1-11-7-6(8)9-5-4-12-3-2-10(5)7/h2-4H2,1H3.
What are the key properties of 2-bromo-3-methoxy-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine?
2-bromo-3-methoxy-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine has a molecular weight of 233.06 g/mol, XLogP of 1.18, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-3-methoxy-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine is sourced from PubChem (CID 125454518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).