3-(3-methylcyclobutyl)triazolo[4,5-b]pyridine

C10H12N4 — CID 168997176

IUPAC3-(3-methylcyclobutyl)triazolo[4,5-b]pyridine
SMILESCC1CC(n2nnc3cccnc32)C1
InChIInChI=1S/C10H12N4/c1-7-5-8(6-7)14-10-9(12-13-14)3-2-4-11-10/h2-4,7-8H,5-6H2,1H3
InChIKeyUWIGCSXTZMSNOS-UHFFFAOYSA-N
MW188.23 g/mol
LogP1.80
Rot. Bonds1

About 3-(3-methylcyclobutyl)triazolo[4,5-b]pyridine

3-(3-methylcyclobutyl)triazolo[4,5-b]pyridine (PubChem CID 168997176) has the molecular formula C10H12N4 and a molecular weight of 188.23 g/mol. Its IUPAC name is 3-(3-methylcyclobutyl)triazolo[4,5-b]pyridine.

Molecular Properties

Compound Name3-(3-methylcyclobutyl)triazolo[4,5-b]pyridine
PubChem CID168997176
Molecular FormulaC10H12N4
Molecular Weight188.23 g/mol
Exact Mass188.11
IUPAC Name3-(3-methylcyclobutyl)triazolo[4,5-b]pyridine
SMILESCC1CC(n2nnc3cccnc32)C1
InChIInChI=1S/C10H12N4/c1-7-5-8(6-7)14-10-9(12-13-14)3-2-4-11-10/h2-4,7-8H,5-6H2,1H3
InChIKeyUWIGCSXTZMSNOS-UHFFFAOYSA-N
XLogP1.80
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 51.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(3-methylcyclobutyl)triazolo[4,5-b]pyridine?
The IUPAC name of 3-(3-methylcyclobutyl)triazolo[4,5-b]pyridine (CID 168997176) is 3-(3-methylcyclobutyl)triazolo[4,5-b]pyridine.
What is the SMILES notation for 3-(3-methylcyclobutyl)triazolo[4,5-b]pyridine?
The canonical SMILES for 3-(3-methylcyclobutyl)triazolo[4,5-b]pyridine is CC1CC(n2nnc3cccnc32)C1.
What is the InChIKey of 3-(3-methylcyclobutyl)triazolo[4,5-b]pyridine?
The InChIKey is UWIGCSXTZMSNOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4/c1-7-5-8(6-7)14-10-9(12-13-14)3-2-4-11-10/h2-4,7-8H,5-6H2,1H3.
What are the key properties of 3-(3-methylcyclobutyl)triazolo[4,5-b]pyridine?
3-(3-methylcyclobutyl)triazolo[4,5-b]pyridine has a molecular weight of 188.23 g/mol, XLogP of 1.80, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methylcyclobutyl)triazolo[4,5-b]pyridine is sourced from PubChem (CID 168997176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).