2-(2-amino-5-bromo-1,3-oxazol-4-yl)phenol

C9H7BrN2O2 — CID 12544240

IUPAC2-(2-amino-5-bromo-1,3-oxazol-4-yl)phenol
SMILESNc1nc(-c2ccccc2O)c(Br)o1
InChIInChI=1S/C9H7BrN2O2/c10-8-7(12-9(11)14-8)5-3-1-2-4-6(5)13/h1-4,13H,(H2,11,12)
InChIKeySZDVFEGLANYHIB-UHFFFAOYSA-N
MW255.07 g/mol
LogP2.39
Rot. Bonds1

About 2-(2-amino-5-bromo-1,3-oxazol-4-yl)phenol

2-(2-amino-5-bromo-1,3-oxazol-4-yl)phenol (PubChem CID 12544240) has the molecular formula C9H7BrN2O2 and a molecular weight of 255.07 g/mol. Its IUPAC name is 2-(2-amino-5-bromo-1,3-oxazol-4-yl)phenol.

Molecular Properties

Compound Name2-(2-amino-5-bromo-1,3-oxazol-4-yl)phenol
PubChem CID12544240
Molecular FormulaC9H7BrN2O2
Molecular Weight255.07 g/mol
Exact Mass253.97
IUPAC Name2-(2-amino-5-bromo-1,3-oxazol-4-yl)phenol
SMILESNc1nc(-c2ccccc2O)c(Br)o1
InChIInChI=1S/C9H7BrN2O2/c10-8-7(12-9(11)14-8)5-3-1-2-4-6(5)13/h1-4,13H,(H2,11,12)
InChIKeySZDVFEGLANYHIB-UHFFFAOYSA-N
XLogP2.39
TPSA72.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.07
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-4-(1H-indol-2-yl)-1,3-oxazol-2-amine
CID 150300739
2-(5-amino-2-methyl-1,3-thiazol-4-yl)phenol
CID 84779153
2-[3,5-difluoro-6-(2-hydroxyphenyl)pyrazin-2-yl]phenol
CID 140692175
2-[2-(1-aminoethyl)-5-methyl-1,3-oxazol-4-yl]phenol
CID 115030601
2-(3-amino-4-bromophenyl)phenol
CID 115049178
2-(2-hydroxyphenyl)phenol;naphthalene
CID 70386801
2-(3,5-diamino-2-pyridinyl)phenol
CID 136765356
2-(2,4,7-triaminopteridin-6-yl)phenol
CID 135735591
2-[2-amino-5-(4-hydroxyphenyl)pyrimidin-4-yl]phenol
CID 135960806
2-(2-amino-5-methyl-1,3-oxazol-4-yl)benzaldehyde
CID 105454155
5-bromo-4-(2-chlorophenyl)-2-propan-2-yl-1,3-oxazole
CID 69123329
2-[5-(aminomethyl)-2-methylpyrimidin-4-yl]phenol
CID 136866681

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-5-bromo-1,3-oxazol-4-yl)phenol?
The IUPAC name of 2-(2-amino-5-bromo-1,3-oxazol-4-yl)phenol (CID 12544240) is 2-(2-amino-5-bromo-1,3-oxazol-4-yl)phenol.
What is the SMILES notation for 2-(2-amino-5-bromo-1,3-oxazol-4-yl)phenol?
The canonical SMILES for 2-(2-amino-5-bromo-1,3-oxazol-4-yl)phenol is Nc1nc(-c2ccccc2O)c(Br)o1.
What is the InChIKey of 2-(2-amino-5-bromo-1,3-oxazol-4-yl)phenol?
The InChIKey is SZDVFEGLANYHIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7BrN2O2/c10-8-7(12-9(11)14-8)5-3-1-2-4-6(5)13/h1-4,13H,(H2,11,12).
What are the key properties of 2-(2-amino-5-bromo-1,3-oxazol-4-yl)phenol?
2-(2-amino-5-bromo-1,3-oxazol-4-yl)phenol has a molecular weight of 255.07 g/mol, XLogP of 2.39, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-5-bromo-1,3-oxazol-4-yl)phenol is sourced from PubChem (CID 12544240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).