2-amino-5-bromo-4-(difluoromethyl)pyridin-3-ol

C6H5BrF2N2O — CID 130101681

IUPAC2-amino-5-bromo-4-(difluoromethyl)pyridin-3-ol
SMILESNc1ncc(Br)c(C(F)F)c1O
InChIInChI=1S/C6H5BrF2N2O/c7-2-1-11-6(10)4(12)3(2)5(8)9/h1,5,12H,(H2,10,11)
InChIKeyZRVVJSVJBURBLA-UHFFFAOYSA-N
MW239.02 g/mol
LogP2.07
Rot. Bonds1

About 2-amino-5-bromo-4-(difluoromethyl)pyridin-3-ol

2-amino-5-bromo-4-(difluoromethyl)pyridin-3-ol (PubChem CID 130101681) has the molecular formula C6H5BrF2N2O and a molecular weight of 239.02 g/mol. Its IUPAC name is 2-amino-5-bromo-4-(difluoromethyl)pyridin-3-ol.

Molecular Properties

Compound Name2-amino-5-bromo-4-(difluoromethyl)pyridin-3-ol
PubChem CID130101681
Molecular FormulaC6H5BrF2N2O
Molecular Weight239.02 g/mol
Exact Mass237.96
IUPAC Name2-amino-5-bromo-4-(difluoromethyl)pyridin-3-ol
SMILESNc1ncc(Br)c(C(F)F)c1O
InChIInChI=1S/C6H5BrF2N2O/c7-2-1-11-6(10)4(12)3(2)5(8)9/h1,5,12H,(H2,10,11)
InChIKeyZRVVJSVJBURBLA-UHFFFAOYSA-N
XLogP2.07
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.02
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-5-bromo-4-fluoropyridin-3-ol
CID 21436673
5-bromo-3-(difluoromethyl)-4-fluoropyridin-2-amine
CID 119016781
2-amino-4-(difluoromethyl)-5-(trifluoromethyl)pyridin-3-ol
CID 118993704
6-amino-4-(difluoromethyl)-5-hydroxypyridine-3-carbaldehyde
CID 130104859
[2-amino-5-bromo-3-(difluoromethyl)-4-pyridinyl]methanol
CID 130102040
6-amino-4-(difluoromethyl)-5-hydroxypyridine-3-sulfonyl chloride
CID 130105042
[6-amino-4-bromo-5-(difluoromethyl)-3-pyridinyl]methanol
CID 118991598
ethyl 2-amino-5-bromo-3-(difluoromethyl)pyridine-4-carboxylate
CID 134683617
6-amino-4-bromo-5-(difluoromethyl)pyridine-3-carboxylic acid
CID 118994678
2-amino-4-(aminomethyl)-5-(difluoromethyl)pyridin-3-ol
CID 118997020
3,5-dibromo-4-(difluoromethyl)-2-methylpyridine
CID 130098940
4,5-dichloro-3-(difluoromethyl)pyridin-2-amine
CID 119024495

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-bromo-4-(difluoromethyl)pyridin-3-ol?
The IUPAC name of 2-amino-5-bromo-4-(difluoromethyl)pyridin-3-ol (CID 130101681) is 2-amino-5-bromo-4-(difluoromethyl)pyridin-3-ol.
What is the SMILES notation for 2-amino-5-bromo-4-(difluoromethyl)pyridin-3-ol?
The canonical SMILES for 2-amino-5-bromo-4-(difluoromethyl)pyridin-3-ol is Nc1ncc(Br)c(C(F)F)c1O.
What is the InChIKey of 2-amino-5-bromo-4-(difluoromethyl)pyridin-3-ol?
The InChIKey is ZRVVJSVJBURBLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5BrF2N2O/c7-2-1-11-6(10)4(12)3(2)5(8)9/h1,5,12H,(H2,10,11).
What are the key properties of 2-amino-5-bromo-4-(difluoromethyl)pyridin-3-ol?
2-amino-5-bromo-4-(difluoromethyl)pyridin-3-ol has a molecular weight of 239.02 g/mol, XLogP of 2.07, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-bromo-4-(difluoromethyl)pyridin-3-ol is sourced from PubChem (CID 130101681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).