2-(4-methoxypyrimidin-5-yl)-1,5-dimethylpyrrolo[2,3-c]pyridine

C14H14N4O — CID 163252464

IUPAC2-(4-methoxypyrimidin-5-yl)-1,5-dimethylpyrrolo[2,3-c]pyridine
SMILESCOc1ncncc1-c1cc2cc(C)ncc2n1C
InChIInChI=1S/C14H14N4O/c1-9-4-10-5-12(18(2)13(10)7-16-9)11-6-15-8-17-14(11)19-3/h4-8H,1-3H3
InChIKeyGVXKWWXJOFSYCL-UHFFFAOYSA-N
MW254.29 g/mol
LogP2.35
Rot. Bonds2

About 2-(4-methoxypyrimidin-5-yl)-1,5-dimethylpyrrolo[2,3-c]pyridine

2-(4-methoxypyrimidin-5-yl)-1,5-dimethylpyrrolo[2,3-c]pyridine (PubChem CID 163252464) has the molecular formula C14H14N4O and a molecular weight of 254.29 g/mol. Its IUPAC name is 2-(4-methoxypyrimidin-5-yl)-1,5-dimethylpyrrolo[2,3-c]pyridine.

Molecular Properties

Compound Name2-(4-methoxypyrimidin-5-yl)-1,5-dimethylpyrrolo[2,3-c]pyridine
PubChem CID163252464
Molecular FormulaC14H14N4O
Molecular Weight254.29 g/mol
Exact Mass254.12
IUPAC Name2-(4-methoxypyrimidin-5-yl)-1,5-dimethylpyrrolo[2,3-c]pyridine
SMILESCOc1ncncc1-c1cc2cc(C)ncc2n1C
InChIInChI=1S/C14H14N4O/c1-9-4-10-5-12(18(2)13(10)7-16-9)11-6-15-8-17-14(11)19-3/h4-8H,1-3H3
InChIKeyGVXKWWXJOFSYCL-UHFFFAOYSA-N
XLogP2.35
TPSA52.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-(4-methoxypyrimidin-5-yl)-1,5-dimethylpyrrolo[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 2-(4-methoxypyrimidin-5-yl)-1,5-dimethylpyrrolo[2,3-c]pyridine?
The IUPAC name of 2-(4-methoxypyrimidin-5-yl)-1,5-dimethylpyrrolo[2,3-c]pyridine (CID 163252464) is 2-(4-methoxypyrimidin-5-yl)-1,5-dimethylpyrrolo[2,3-c]pyridine.
What is the SMILES notation for 2-(4-methoxypyrimidin-5-yl)-1,5-dimethylpyrrolo[2,3-c]pyridine?
The canonical SMILES for 2-(4-methoxypyrimidin-5-yl)-1,5-dimethylpyrrolo[2,3-c]pyridine is COc1ncncc1-c1cc2cc(C)ncc2n1C.
What is the InChIKey of 2-(4-methoxypyrimidin-5-yl)-1,5-dimethylpyrrolo[2,3-c]pyridine?
The InChIKey is GVXKWWXJOFSYCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O/c1-9-4-10-5-12(18(2)13(10)7-16-9)11-6-15-8-17-14(11)19-3/h4-8H,1-3H3.
What are the key properties of 2-(4-methoxypyrimidin-5-yl)-1,5-dimethylpyrrolo[2,3-c]pyridine?
2-(4-methoxypyrimidin-5-yl)-1,5-dimethylpyrrolo[2,3-c]pyridine has a molecular weight of 254.29 g/mol, XLogP of 2.35, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxypyrimidin-5-yl)-1,5-dimethylpyrrolo[2,3-c]pyridine is sourced from PubChem (CID 163252464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).