5-tert-butyltriazolo[1,5-a]pyridine

C10H13N3 — CID 58270238

IUPAC5-tert-butyltriazolo[1,5-a]pyridine
SMILESCC(C)(C)c1ccn2nncc2c1
InChIInChI=1S/C10H13N3/c1-10(2,3)8-4-5-13-9(6-8)7-11-12-13/h4-7H,1-3H3
InChIKeyYOJJWARRDSUHQQ-UHFFFAOYSA-N
MW175.23 g/mol
LogP2.03
Rot. Bonds

About 5-tert-butyltriazolo[1,5-a]pyridine

5-tert-butyltriazolo[1,5-a]pyridine (PubChem CID 58270238) has the molecular formula C10H13N3 and a molecular weight of 175.23 g/mol. Its IUPAC name is 5-tert-butyltriazolo[1,5-a]pyridine.

Molecular Properties

Compound Name5-tert-butyltriazolo[1,5-a]pyridine
PubChem CID58270238
Molecular FormulaC10H13N3
Molecular Weight175.23 g/mol
Exact Mass175.11
IUPAC Name5-tert-butyltriazolo[1,5-a]pyridine
SMILESCC(C)(C)c1ccn2nncc2c1
InChIInChI=1S/C10H13N3/c1-10(2,3)8-4-5-13-9(6-8)7-11-12-13/h4-7H,1-3H3
InChIKeyYOJJWARRDSUHQQ-UHFFFAOYSA-N
XLogP2.03
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-tert-butyltriazolo[1,5-a]pyridine?
The IUPAC name of 5-tert-butyltriazolo[1,5-a]pyridine (CID 58270238) is 5-tert-butyltriazolo[1,5-a]pyridine.
What is the SMILES notation for 5-tert-butyltriazolo[1,5-a]pyridine?
The canonical SMILES for 5-tert-butyltriazolo[1,5-a]pyridine is CC(C)(C)c1ccn2nncc2c1.
What is the InChIKey of 5-tert-butyltriazolo[1,5-a]pyridine?
The InChIKey is YOJJWARRDSUHQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3/c1-10(2,3)8-4-5-13-9(6-8)7-11-12-13/h4-7H,1-3H3.
What are the key properties of 5-tert-butyltriazolo[1,5-a]pyridine?
5-tert-butyltriazolo[1,5-a]pyridine has a molecular weight of 175.23 g/mol, XLogP of 2.03, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-tert-butyltriazolo[1,5-a]pyridine is sourced from PubChem (CID 58270238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).