4-(5-chloro-[1,3]thiazolo[4,5-b]pyridin-2-yl)morpholine

C10H10ClN3OS — CID 118224392

IUPAC4-(5-chloro-[1,3]thiazolo[4,5-b]pyridin-2-yl)morpholine
SMILESClc1ccc2sc(N3CCOCC3)nc2n1
InChIInChI=1S/C10H10ClN3OS/c11-8-2-1-7-9(12-8)13-10(16-7)14-3-5-15-6-4-14/h1-2H,3-6H2
InChIKeyKEELLVUDYSBEOD-UHFFFAOYSA-N
MW255.73 g/mol
LogP2.18
Rot. Bonds1

About 4-(5-chloro-[1,3]thiazolo[4,5-b]pyridin-2-yl)morpholine

4-(5-chloro-[1,3]thiazolo[4,5-b]pyridin-2-yl)morpholine (PubChem CID 118224392) has the molecular formula C10H10ClN3OS and a molecular weight of 255.73 g/mol. Its IUPAC name is 4-(5-chloro-[1,3]thiazolo[4,5-b]pyridin-2-yl)morpholine.

Molecular Properties

Compound Name4-(5-chloro-[1,3]thiazolo[4,5-b]pyridin-2-yl)morpholine
PubChem CID118224392
Molecular FormulaC10H10ClN3OS
Molecular Weight255.73 g/mol
Exact Mass255.02
IUPAC Name4-(5-chloro-[1,3]thiazolo[4,5-b]pyridin-2-yl)morpholine
SMILESClc1ccc2sc(N3CCOCC3)nc2n1
InChIInChI=1S/C10H10ClN3OS/c11-8-2-1-7-9(12-8)13-10(16-7)14-3-5-15-6-4-14/h1-2H,3-6H2
InChIKeyKEELLVUDYSBEOD-UHFFFAOYSA-N
XLogP2.18
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.73
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-(5-chloro-[1,3]thiazolo[4,5-b]pyridin-2-yl)morpholine?
The IUPAC name of 4-(5-chloro-[1,3]thiazolo[4,5-b]pyridin-2-yl)morpholine (CID 118224392) is 4-(5-chloro-[1,3]thiazolo[4,5-b]pyridin-2-yl)morpholine.
What is the SMILES notation for 4-(5-chloro-[1,3]thiazolo[4,5-b]pyridin-2-yl)morpholine?
The canonical SMILES for 4-(5-chloro-[1,3]thiazolo[4,5-b]pyridin-2-yl)morpholine is Clc1ccc2sc(N3CCOCC3)nc2n1.
What is the InChIKey of 4-(5-chloro-[1,3]thiazolo[4,5-b]pyridin-2-yl)morpholine?
The InChIKey is KEELLVUDYSBEOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClN3OS/c11-8-2-1-7-9(12-8)13-10(16-7)14-3-5-15-6-4-14/h1-2H,3-6H2.
What are the key properties of 4-(5-chloro-[1,3]thiazolo[4,5-b]pyridin-2-yl)morpholine?
4-(5-chloro-[1,3]thiazolo[4,5-b]pyridin-2-yl)morpholine has a molecular weight of 255.73 g/mol, XLogP of 2.18, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-chloro-[1,3]thiazolo[4,5-b]pyridin-2-yl)morpholine is sourced from PubChem (CID 118224392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).