2-[3-(triazol-2-yl)azetidin-1-yl]-[1,3]thiazolo[4,5-c]pyridine

C11H10N6S — CID 146079856

IUPAC2-[3-(triazol-2-yl)azetidin-1-yl]-[1,3]thiazolo[4,5-c]pyridine
SMILESc1cc2sc(N3CC(n4nccn4)C3)nc2cn1
InChIInChI=1S/C11H10N6S/c1-2-12-5-9-10(1)18-11(15-9)16-6-8(7-16)17-13-3-4-14-17/h1-5,8H,6-7H2
InChIKeyPMNABHGZCMWBQR-UHFFFAOYSA-N
MW258.31 g/mol
LogP1.34
Rot. Bonds2

About 2-[3-(triazol-2-yl)azetidin-1-yl]-[1,3]thiazolo[4,5-c]pyridine

2-[3-(triazol-2-yl)azetidin-1-yl]-[1,3]thiazolo[4,5-c]pyridine (PubChem CID 146079856) has the molecular formula C11H10N6S and a molecular weight of 258.31 g/mol. Its IUPAC name is 2-[3-(triazol-2-yl)azetidin-1-yl]-[1,3]thiazolo[4,5-c]pyridine.

Molecular Properties

Compound Name2-[3-(triazol-2-yl)azetidin-1-yl]-[1,3]thiazolo[4,5-c]pyridine
PubChem CID146079856
Molecular FormulaC11H10N6S
Molecular Weight258.31 g/mol
Exact Mass258.07
IUPAC Name2-[3-(triazol-2-yl)azetidin-1-yl]-[1,3]thiazolo[4,5-c]pyridine
SMILESc1cc2sc(N3CC(n4nccn4)C3)nc2cn1
InChIInChI=1S/C11H10N6S/c1-2-12-5-9-10(1)18-11(15-9)16-6-8(7-16)17-13-3-4-14-17/h1-5,8H,6-7H2
InChIKeyPMNABHGZCMWBQR-UHFFFAOYSA-N
XLogP1.34
TPSA59.73 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.31
LogP ≤ 51.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-[3-(triazol-2-yl)azetidin-1-yl]-[1,3]thiazolo[4,5-c]pyridine?
The IUPAC name of 2-[3-(triazol-2-yl)azetidin-1-yl]-[1,3]thiazolo[4,5-c]pyridine (CID 146079856) is 2-[3-(triazol-2-yl)azetidin-1-yl]-[1,3]thiazolo[4,5-c]pyridine.
What is the SMILES notation for 2-[3-(triazol-2-yl)azetidin-1-yl]-[1,3]thiazolo[4,5-c]pyridine?
The canonical SMILES for 2-[3-(triazol-2-yl)azetidin-1-yl]-[1,3]thiazolo[4,5-c]pyridine is c1cc2sc(N3CC(n4nccn4)C3)nc2cn1.
What is the InChIKey of 2-[3-(triazol-2-yl)azetidin-1-yl]-[1,3]thiazolo[4,5-c]pyridine?
The InChIKey is PMNABHGZCMWBQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N6S/c1-2-12-5-9-10(1)18-11(15-9)16-6-8(7-16)17-13-3-4-14-17/h1-5,8H,6-7H2.
What are the key properties of 2-[3-(triazol-2-yl)azetidin-1-yl]-[1,3]thiazolo[4,5-c]pyridine?
2-[3-(triazol-2-yl)azetidin-1-yl]-[1,3]thiazolo[4,5-c]pyridine has a molecular weight of 258.31 g/mol, XLogP of 1.34, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(triazol-2-yl)azetidin-1-yl]-[1,3]thiazolo[4,5-c]pyridine is sourced from PubChem (CID 146079856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).