6-chloro-2-(oxan-4-yl)-[1,3]thiazolo[5,4-c]pyridine

C11H11ClN2OS — CID 170726165

IUPAC6-chloro-2-(oxan-4-yl)-[1,3]thiazolo[5,4-c]pyridine
SMILESClc1cc2nc(C3CCOCC3)sc2cn1
InChIInChI=1S/C11H11ClN2OS/c12-10-5-8-9(6-13-10)16-11(14-8)7-1-3-15-4-2-7/h5-7H,1-4H2
InChIKeyPEJICEAAXBYJDO-UHFFFAOYSA-N
MW254.74 g/mol
LogP3.24
Rot. Bonds1

About 6-chloro-2-(oxan-4-yl)-[1,3]thiazolo[5,4-c]pyridine

6-chloro-2-(oxan-4-yl)-[1,3]thiazolo[5,4-c]pyridine (PubChem CID 170726165) has the molecular formula C11H11ClN2OS and a molecular weight of 254.74 g/mol. Its IUPAC name is 6-chloro-2-(oxan-4-yl)-[1,3]thiazolo[5,4-c]pyridine.

Molecular Properties

Compound Name6-chloro-2-(oxan-4-yl)-[1,3]thiazolo[5,4-c]pyridine
PubChem CID170726165
Molecular FormulaC11H11ClN2OS
Molecular Weight254.74 g/mol
Exact Mass254.03
IUPAC Name6-chloro-2-(oxan-4-yl)-[1,3]thiazolo[5,4-c]pyridine
SMILESClc1cc2nc(C3CCOCC3)sc2cn1
InChIInChI=1S/C11H11ClN2OS/c12-10-5-8-9(6-13-10)16-11(14-8)7-1-3-15-4-2-7/h5-7H,1-4H2
InChIKeyPEJICEAAXBYJDO-UHFFFAOYSA-N
XLogP3.24
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.74
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 6-chloro-2-(oxan-4-yl)-[1,3]thiazolo[5,4-c]pyridine with MolForge

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

Launch Full Analysis

Related Compounds

7-chloro-2-(oxan-4-yl)-[1,3]thiazolo[5,4-d]pyrimidine
CID 132588404
5-chloro-2-(oxolan-3-yl)-1,3-thiazole
CID 117259060
3-(5-chloro-1,3-benzothiazol-2-yl)cyclopentan-1-amine
CID 66030593
5-chloro-1-(oxan-4-yl)pyrazolo[3,4-c]pyridine
CID 121416628
6-chloro-1-(oxan-4-yl)pyrazolo[4,3-c]pyridine
CID 166460362
2-(oxan-4-yl)-5,6,7,8-tetrahydro-4H-[1,3]thiazolo[4,5-d]azepine;hydrobromide
CID 162325589
2-cyclodecyl-5-cyclooctylthieno[2,3-d][1,3]thiazole
CID 166923022
tert-butyl (3S)-3-methyl-6-[2-(oxan-4-yl)-1,3-benzothiazol-5-yl]-3,4-dihydro-2H-pyridine-1-carboxylate
CID 164752751
6-chloro-2-(oxan-4-yl)pyrimidin-4-amine
CID 138039841
4-chloro-6-methyl-2-(oxan-4-yl)pyrimidine
CID 62386473
5-chloro-2-pyrrolidin-3-yl-1,3-benzothiazole
CID 63030611
4-(2-cyclopropyl-1,3-benzothiazol-5-yl)-1,2-oxazol-5-amine
CID 117396578

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-(oxan-4-yl)-[1,3]thiazolo[5,4-c]pyridine?
The IUPAC name of 6-chloro-2-(oxan-4-yl)-[1,3]thiazolo[5,4-c]pyridine (CID 170726165) is 6-chloro-2-(oxan-4-yl)-[1,3]thiazolo[5,4-c]pyridine.
What is the SMILES notation for 6-chloro-2-(oxan-4-yl)-[1,3]thiazolo[5,4-c]pyridine?
The canonical SMILES for 6-chloro-2-(oxan-4-yl)-[1,3]thiazolo[5,4-c]pyridine is Clc1cc2nc(C3CCOCC3)sc2cn1.
What is the InChIKey of 6-chloro-2-(oxan-4-yl)-[1,3]thiazolo[5,4-c]pyridine?
The InChIKey is PEJICEAAXBYJDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11ClN2OS/c12-10-5-8-9(6-13-10)16-11(14-8)7-1-3-15-4-2-7/h5-7H,1-4H2.
What are the key properties of 6-chloro-2-(oxan-4-yl)-[1,3]thiazolo[5,4-c]pyridine?
6-chloro-2-(oxan-4-yl)-[1,3]thiazolo[5,4-c]pyridine has a molecular weight of 254.74 g/mol, XLogP of 3.24, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-(oxan-4-yl)-[1,3]thiazolo[5,4-c]pyridine is sourced from PubChem (CID 170726165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).