(3-amino-5-bromo-4-pyridinyl)methanol

C6H7BrN2O — CID 130656205

IUPAC(3-amino-5-bromo-4-pyridinyl)methanol
SMILESNc1cncc(Br)c1CO
InChIInChI=1S/C6H7BrN2O/c7-5-1-9-2-6(8)4(5)3-10/h1-2,10H,3,8H2
InChIKeyIGONUJHMVZCENO-UHFFFAOYSA-N
MW203.04 g/mol
LogP0.92
Rot. Bonds1

About (3-amino-5-bromo-4-pyridinyl)methanol

(3-amino-5-bromo-4-pyridinyl)methanol (PubChem CID 130656205) has the molecular formula C6H7BrN2O and a molecular weight of 203.04 g/mol. Its IUPAC name is (3-amino-5-bromo-4-pyridinyl)methanol.

Molecular Properties

Compound Name(3-amino-5-bromo-4-pyridinyl)methanol
PubChem CID130656205
Molecular FormulaC6H7BrN2O
Molecular Weight203.04 g/mol
Exact Mass201.97
IUPAC Name(3-amino-5-bromo-4-pyridinyl)methanol
SMILESNc1cncc(Br)c1CO
InChIInChI=1S/C6H7BrN2O/c7-5-1-9-2-6(8)4(5)3-10/h1-2,10H,3,8H2
InChIKeyIGONUJHMVZCENO-UHFFFAOYSA-N
XLogP0.92
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.04
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (3-amino-5-bromo-4-pyridinyl)methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (3-amino-5-bromo-4-pyridinyl)methanol?
The IUPAC name of (3-amino-5-bromo-4-pyridinyl)methanol (CID 130656205) is (3-amino-5-bromo-4-pyridinyl)methanol.
What is the SMILES notation for (3-amino-5-bromo-4-pyridinyl)methanol?
The canonical SMILES for (3-amino-5-bromo-4-pyridinyl)methanol is Nc1cncc(Br)c1CO.
What is the InChIKey of (3-amino-5-bromo-4-pyridinyl)methanol?
The InChIKey is IGONUJHMVZCENO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7BrN2O/c7-5-1-9-2-6(8)4(5)3-10/h1-2,10H,3,8H2.
What are the key properties of (3-amino-5-bromo-4-pyridinyl)methanol?
(3-amino-5-bromo-4-pyridinyl)methanol has a molecular weight of 203.04 g/mol, XLogP of 0.92, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-amino-5-bromo-4-pyridinyl)methanol is sourced from PubChem (CID 130656205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).