3-methyl-7-(2-methyl-4-pyridinyl)-5-pyridin-2-yl-[1,2]oxazolo[4,5-b]pyridine

C18H14N4O — CID 134806649

IUPAC3-methyl-7-(2-methyl-4-pyridinyl)-5-pyridin-2-yl-[1,2]oxazolo[4,5-b]pyridine
SMILESCc1cc(-c2cc(-c3ccccn3)nc3c(C)noc23)ccn1
InChIInChI=1S/C18H14N4O/c1-11-9-13(6-8-19-11)14-10-16(15-5-3-4-7-20-15)21-17-12(2)22-23-18(14)17/h3-10H,1-2H3
InChIKeyMYTPKLMFIKDVOK-UHFFFAOYSA-N
MW302.34 g/mol
LogP3.96
Rot. Bonds2

About 3-methyl-7-(2-methyl-4-pyridinyl)-5-pyridin-2-yl-[1,2]oxazolo[4,5-b]pyridine

3-methyl-7-(2-methyl-4-pyridinyl)-5-pyridin-2-yl-[1,2]oxazolo[4,5-b]pyridine (PubChem CID 134806649) has the molecular formula C18H14N4O and a molecular weight of 302.34 g/mol. Its IUPAC name is 3-methyl-7-(2-methyl-4-pyridinyl)-5-pyridin-2-yl-[1,2]oxazolo[4,5-b]pyridine.

Molecular Properties

Compound Name3-methyl-7-(2-methyl-4-pyridinyl)-5-pyridin-2-yl-[1,2]oxazolo[4,5-b]pyridine
PubChem CID134806649
Molecular FormulaC18H14N4O
Molecular Weight302.34 g/mol
Exact Mass302.12
IUPAC Name3-methyl-7-(2-methyl-4-pyridinyl)-5-pyridin-2-yl-[1,2]oxazolo[4,5-b]pyridine
SMILESCc1cc(-c2cc(-c3ccccn3)nc3c(C)noc23)ccn1
InChIInChI=1S/C18H14N4O/c1-11-9-13(6-8-19-11)14-10-16(15-5-3-4-7-20-15)21-17-12(2)22-23-18(14)17/h3-10H,1-2H3
InChIKeyMYTPKLMFIKDVOK-UHFFFAOYSA-N
XLogP3.96
TPSA64.70 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.34
LogP ≤ 53.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 3-methyl-7-(2-methyl-4-pyridinyl)-5-pyridin-2-yl-[1,2]oxazolo[4,5-b]pyridine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-methyl-7-(2-methyl-4-pyridinyl)-5-pyridin-2-yl-[1,2]oxazolo[4,5-b]pyridine?
The IUPAC name of 3-methyl-7-(2-methyl-4-pyridinyl)-5-pyridin-2-yl-[1,2]oxazolo[4,5-b]pyridine (CID 134806649) is 3-methyl-7-(2-methyl-4-pyridinyl)-5-pyridin-2-yl-[1,2]oxazolo[4,5-b]pyridine.
What is the SMILES notation for 3-methyl-7-(2-methyl-4-pyridinyl)-5-pyridin-2-yl-[1,2]oxazolo[4,5-b]pyridine?
The canonical SMILES for 3-methyl-7-(2-methyl-4-pyridinyl)-5-pyridin-2-yl-[1,2]oxazolo[4,5-b]pyridine is Cc1cc(-c2cc(-c3ccccn3)nc3c(C)noc23)ccn1.
What is the InChIKey of 3-methyl-7-(2-methyl-4-pyridinyl)-5-pyridin-2-yl-[1,2]oxazolo[4,5-b]pyridine?
The InChIKey is MYTPKLMFIKDVOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N4O/c1-11-9-13(6-8-19-11)14-10-16(15-5-3-4-7-20-15)21-17-12(2)22-23-18(14)17/h3-10H,1-2H3.
What are the key properties of 3-methyl-7-(2-methyl-4-pyridinyl)-5-pyridin-2-yl-[1,2]oxazolo[4,5-b]pyridine?
3-methyl-7-(2-methyl-4-pyridinyl)-5-pyridin-2-yl-[1,2]oxazolo[4,5-b]pyridine has a molecular weight of 302.34 g/mol, XLogP of 3.96, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-7-(2-methyl-4-pyridinyl)-5-pyridin-2-yl-[1,2]oxazolo[4,5-b]pyridine is sourced from PubChem (CID 134806649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).