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

C8H11BrN2O2 — CID 125453848

IUPAC2-bromo-3-ethoxy-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine
SMILESCCOc1c(Br)nc2n1CCOC2
InChIInChI=1S/C8H11BrN2O2/c1-2-13-8-7(9)10-6-5-12-4-3-11(6)8/h2-5H2,1H3
InChIKeyOTLQECMJINLGFZ-UHFFFAOYSA-N
MW247.09 g/mol
LogP1.57
Rot. Bonds2

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

2-bromo-3-ethoxy-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine (PubChem CID 125453848) has the molecular formula C8H11BrN2O2 and a molecular weight of 247.09 g/mol. Its IUPAC name is 2-bromo-3-ethoxy-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine.

Molecular Properties

Compound Name2-bromo-3-ethoxy-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine
PubChem CID125453848
Molecular FormulaC8H11BrN2O2
Molecular Weight247.09 g/mol
Exact Mass246.00
IUPAC Name2-bromo-3-ethoxy-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine
SMILESCCOc1c(Br)nc2n1CCOC2
InChIInChI=1S/C8H11BrN2O2/c1-2-13-8-7(9)10-6-5-12-4-3-11(6)8/h2-5H2,1H3
InChIKeyOTLQECMJINLGFZ-UHFFFAOYSA-N
XLogP1.57
TPSA36.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.09
LogP ≤ 51.57
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
N,N-dimethyl-3,4-dihydro-2H-imidazo[5,1-b][1,3]oxazin-8-amine
CID 164104535
2-Bromo-5H,6H,8H-imidazo[2,1-c][1,4]oxazin-3-ol
CID 125453753
2-Bromo-3-methoxy-5H,6H,8H-imidazo[2,1-c][1,4]oxazine
CID 125454518
1,2-dimethyl-6,7-dihydro-5H-imidazo[4,5-b][1,4]oxazine
CID 129974897

Frequently Asked Questions

What is the IUPAC name of 2-bromo-3-ethoxy-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine?
The IUPAC name of 2-bromo-3-ethoxy-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine (CID 125453848) is 2-bromo-3-ethoxy-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine.
What is the SMILES notation for 2-bromo-3-ethoxy-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine?
The canonical SMILES for 2-bromo-3-ethoxy-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine is CCOc1c(Br)nc2n1CCOC2.
What is the InChIKey of 2-bromo-3-ethoxy-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine?
The InChIKey is OTLQECMJINLGFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11BrN2O2/c1-2-13-8-7(9)10-6-5-12-4-3-11(6)8/h2-5H2,1H3.
What are the key properties of 2-bromo-3-ethoxy-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine?
2-bromo-3-ethoxy-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine has a molecular weight of 247.09 g/mol, XLogP of 1.57, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-3-ethoxy-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine is sourced from PubChem (CID 125453848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).