3-methyl-2-pyrimidin-4-ylfuro[2,3-c]pyridine

C12H9N3O — CID 71206428

IUPAC3-methyl-2-pyrimidin-4-ylfuro[2,3-c]pyridine
SMILESCc1c(-c2ccncn2)oc2cnccc12
InChIInChI=1S/C12H9N3O/c1-8-9-2-4-13-6-11(9)16-12(8)10-3-5-14-7-15-10/h2-7H,1H3
InChIKeyXEIWFJAWHITVQA-UHFFFAOYSA-N
MW211.22 g/mol
LogP2.59
Rot. Bonds1

About 3-methyl-2-pyrimidin-4-ylfuro[2,3-c]pyridine

3-methyl-2-pyrimidin-4-ylfuro[2,3-c]pyridine (PubChem CID 71206428) has the molecular formula C12H9N3O and a molecular weight of 211.22 g/mol. Its IUPAC name is 3-methyl-2-pyrimidin-4-ylfuro[2,3-c]pyridine.

Molecular Properties

Compound Name3-methyl-2-pyrimidin-4-ylfuro[2,3-c]pyridine
PubChem CID71206428
Molecular FormulaC12H9N3O
Molecular Weight211.22 g/mol
Exact Mass211.07
IUPAC Name3-methyl-2-pyrimidin-4-ylfuro[2,3-c]pyridine
SMILESCc1c(-c2ccncn2)oc2cnccc12
InChIInChI=1S/C12H9N3O/c1-8-9-2-4-13-6-11(9)16-12(8)10-3-5-14-7-15-10/h2-7H,1H3
InChIKeyXEIWFJAWHITVQA-UHFFFAOYSA-N
XLogP2.59
TPSA51.81 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.22
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 3-methyl-2-pyrimidin-4-ylfuro[2,3-c]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-2-pyrimidin-4-ylfuro[2,3-c]pyridine?
The IUPAC name of 3-methyl-2-pyrimidin-4-ylfuro[2,3-c]pyridine (CID 71206428) is 3-methyl-2-pyrimidin-4-ylfuro[2,3-c]pyridine.
What is the SMILES notation for 3-methyl-2-pyrimidin-4-ylfuro[2,3-c]pyridine?
The canonical SMILES for 3-methyl-2-pyrimidin-4-ylfuro[2,3-c]pyridine is Cc1c(-c2ccncn2)oc2cnccc12.
What is the InChIKey of 3-methyl-2-pyrimidin-4-ylfuro[2,3-c]pyridine?
The InChIKey is XEIWFJAWHITVQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9N3O/c1-8-9-2-4-13-6-11(9)16-12(8)10-3-5-14-7-15-10/h2-7H,1H3.
What are the key properties of 3-methyl-2-pyrimidin-4-ylfuro[2,3-c]pyridine?
3-methyl-2-pyrimidin-4-ylfuro[2,3-c]pyridine has a molecular weight of 211.22 g/mol, XLogP of 2.59, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-pyrimidin-4-ylfuro[2,3-c]pyridine is sourced from PubChem (CID 71206428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).