N-(3-fluorophenyl)-[1,2]oxazolo[4,5-b]pyridin-3-amine;hydrochloride

C12H9ClFN3O — CID 56587823

IUPACN-(3-fluorophenyl)-[1,2]oxazolo[4,5-b]pyridin-3-amine;hydrochloride
SMILESCl.Fc1cccc(Nc2noc3cccnc23)c1
InChIInChI=1S/C12H8FN3O.ClH/c13-8-3-1-4-9(7-8)15-12-11-10(17-16-12)5-2-6-14-11;/h1-7H,(H,15,16);1H
InChIKeyFUVYGYAAQXHMEV-UHFFFAOYSA-N
MW265.68 g/mol
LogP3.53
Rot. Bonds2

About N-(3-fluorophenyl)-[1,2]oxazolo[4,5-b]pyridin-3-amine;hydrochloride

N-(3-fluorophenyl)-[1,2]oxazolo[4,5-b]pyridin-3-amine;hydrochloride (PubChem CID 56587823) has the molecular formula C12H9ClFN3O and a molecular weight of 265.68 g/mol. Its IUPAC name is N-(3-fluorophenyl)-[1,2]oxazolo[4,5-b]pyridin-3-amine;hydrochloride.

Molecular Properties

Compound NameN-(3-fluorophenyl)-[1,2]oxazolo[4,5-b]pyridin-3-amine;hydrochloride
PubChem CID56587823
Molecular FormulaC12H9ClFN3O
Molecular Weight265.68 g/mol
Exact Mass265.04
IUPAC NameN-(3-fluorophenyl)-[1,2]oxazolo[4,5-b]pyridin-3-amine;hydrochloride
SMILESCl.Fc1cccc(Nc2noc3cccnc23)c1
InChIInChI=1S/C12H8FN3O.ClH/c13-8-3-1-4-9(7-8)15-12-11-10(17-16-12)5-2-6-14-11;/h1-7H,(H,15,16);1H
InChIKeyFUVYGYAAQXHMEV-UHFFFAOYSA-N
XLogP3.53
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.68
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(3-fluorophenyl)-[1,2]oxazolo[4,5-b]pyridin-3-amine;hydrochloride 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 N-(3-fluorophenyl)-[1,2]oxazolo[4,5-b]pyridin-3-amine;hydrochloride?
The IUPAC name of N-(3-fluorophenyl)-[1,2]oxazolo[4,5-b]pyridin-3-amine;hydrochloride (CID 56587823) is N-(3-fluorophenyl)-[1,2]oxazolo[4,5-b]pyridin-3-amine;hydrochloride.
What is the SMILES notation for N-(3-fluorophenyl)-[1,2]oxazolo[4,5-b]pyridin-3-amine;hydrochloride?
The canonical SMILES for N-(3-fluorophenyl)-[1,2]oxazolo[4,5-b]pyridin-3-amine;hydrochloride is Cl.Fc1cccc(Nc2noc3cccnc23)c1.
What is the InChIKey of N-(3-fluorophenyl)-[1,2]oxazolo[4,5-b]pyridin-3-amine;hydrochloride?
The InChIKey is FUVYGYAAQXHMEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8FN3O.ClH/c13-8-3-1-4-9(7-8)15-12-11-10(17-16-12)5-2-6-14-11;/h1-7H,(H,15,16);1H.
What are the key properties of N-(3-fluorophenyl)-[1,2]oxazolo[4,5-b]pyridin-3-amine;hydrochloride?
N-(3-fluorophenyl)-[1,2]oxazolo[4,5-b]pyridin-3-amine;hydrochloride has a molecular weight of 265.68 g/mol, XLogP of 3.53, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-[1,2]oxazolo[4,5-b]pyridin-3-amine;hydrochloride is sourced from PubChem (CID 56587823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).