5-bromo-3-cyclopentyl-[1,2]oxazolo[5,4-b]pyridine

C11H11BrN2O — CID 83913442

IUPAC5-bromo-3-cyclopentyl-[1,2]oxazolo[5,4-b]pyridine
SMILESBrc1cnc2onc(C3CCCC3)c2c1
InChIInChI=1S/C11H11BrN2O/c12-8-5-9-10(7-3-1-2-4-7)14-15-11(9)13-6-8/h5-7H,1-4H2
InChIKeyPUAUPZWNKJWPOK-UHFFFAOYSA-N
MW267.13 g/mol
LogP3.64
Rot. Bonds1

About 5-bromo-3-cyclopentyl-[1,2]oxazolo[5,4-b]pyridine

5-bromo-3-cyclopentyl-[1,2]oxazolo[5,4-b]pyridine (PubChem CID 83913442) has the molecular formula C11H11BrN2O and a molecular weight of 267.13 g/mol. Its IUPAC name is 5-bromo-3-cyclopentyl-[1,2]oxazolo[5,4-b]pyridine.

Molecular Properties

Compound Name5-bromo-3-cyclopentyl-[1,2]oxazolo[5,4-b]pyridine
PubChem CID83913442
Molecular FormulaC11H11BrN2O
Molecular Weight267.13 g/mol
Exact Mass266.01
IUPAC Name5-bromo-3-cyclopentyl-[1,2]oxazolo[5,4-b]pyridine
SMILESBrc1cnc2onc(C3CCCC3)c2c1
InChIInChI=1S/C11H11BrN2O/c12-8-5-9-10(7-3-1-2-4-7)14-15-11(9)13-6-8/h5-7H,1-4H2
InChIKeyPUAUPZWNKJWPOK-UHFFFAOYSA-N
XLogP3.64
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.13
LogP ≤ 53.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-cyclopentyl-5-[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]-[1,2]oxazolo[5,4-b]pyridine
CID 56804585
5-bromo-3-phenyl-[1,2]oxazolo[5,4-b]pyridine
CID 83913838
4-bromo-3-cyclopentyl-1,2-oxazol-5-amine
CID 83911607
3-cyclopropyl-5-[5-[(1R,2S)-2-methylcyclopropyl]-1,3,4-oxadiazol-2-yl]-[1,2]oxazolo[5,4-b]pyridine
CID 95618377
3-cyclopropyl-5-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]-[1,2]oxazolo[5,4-b]pyridine
CID 56785780
5-bromo-3-cyclopentyl-2-methoxypyridine
CID 172993694
(2R)-2-[(3-cyclopropyl-[1,2]oxazolo[5,4-b]pyridin-5-yl)sulfonylamino]propanoic acid
CID 122069616
6-bromo-2-cyclobutylpyrazolo[1,5-a]pyrimidin-3-amine
CID 115049666
2-[(3-cyclopropyl-[1,2]oxazolo[5,4-b]pyridin-5-yl)sulfonyl-(2,2-dimethylpropyl)amino]acetic acid
CID 167757920
2-[(3-cyclopropyl-[1,2]oxazolo[5,4-b]pyridin-5-yl)sulfonylamino]hexanoic acid
CID 122070064
6-bromo-1-cyclohexylisoquinoline
CID 156598771
1-(5-bromo-2-pyridinyl)-3-cyclopentylpyrazol-4-amine
CID 83223329

Frequently Asked Questions

What is the IUPAC name of 5-bromo-3-cyclopentyl-[1,2]oxazolo[5,4-b]pyridine?
The IUPAC name of 5-bromo-3-cyclopentyl-[1,2]oxazolo[5,4-b]pyridine (CID 83913442) is 5-bromo-3-cyclopentyl-[1,2]oxazolo[5,4-b]pyridine.
What is the SMILES notation for 5-bromo-3-cyclopentyl-[1,2]oxazolo[5,4-b]pyridine?
The canonical SMILES for 5-bromo-3-cyclopentyl-[1,2]oxazolo[5,4-b]pyridine is Brc1cnc2onc(C3CCCC3)c2c1.
What is the InChIKey of 5-bromo-3-cyclopentyl-[1,2]oxazolo[5,4-b]pyridine?
The InChIKey is PUAUPZWNKJWPOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11BrN2O/c12-8-5-9-10(7-3-1-2-4-7)14-15-11(9)13-6-8/h5-7H,1-4H2.
What are the key properties of 5-bromo-3-cyclopentyl-[1,2]oxazolo[5,4-b]pyridine?
5-bromo-3-cyclopentyl-[1,2]oxazolo[5,4-b]pyridine has a molecular weight of 267.13 g/mol, XLogP of 3.64, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-3-cyclopentyl-[1,2]oxazolo[5,4-b]pyridine is sourced from PubChem (CID 83913442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).