methyl 5-methyl-3-pyridin-2-yl-1H-pyrrolo[2,3-c]pyridine-7-carboxylate

C15H13N3O2 — CID 71472796

IUPACmethyl 5-methyl-3-pyridin-2-yl-1H-pyrrolo[2,3-c]pyridine-7-carboxylate
SMILESCOC(=O)c1nc(C)cc2c(-c3ccccn3)c[nH]c12
InChIInChI=1S/C15H13N3O2/c1-9-7-10-11(12-5-3-4-6-16-12)8-17-13(10)14(18-9)15(19)20-2/h3-8,17H,1-2H3
InChIKeyNBYKSPLXGZJYET-UHFFFAOYSA-N
MW267.29 g/mol
LogP2.72
Rot. Bonds2

About methyl 5-methyl-3-pyridin-2-yl-1H-pyrrolo[2,3-c]pyridine-7-carboxylate

methyl 5-methyl-3-pyridin-2-yl-1H-pyrrolo[2,3-c]pyridine-7-carboxylate (PubChem CID 71472796) has the molecular formula C15H13N3O2 and a molecular weight of 267.29 g/mol. Its IUPAC name is methyl 5-methyl-3-pyridin-2-yl-1H-pyrrolo[2,3-c]pyridine-7-carboxylate.

Molecular Properties

Compound Namemethyl 5-methyl-3-pyridin-2-yl-1H-pyrrolo[2,3-c]pyridine-7-carboxylate
PubChem CID71472796
Molecular FormulaC15H13N3O2
Molecular Weight267.29 g/mol
Exact Mass267.10
IUPAC Namemethyl 5-methyl-3-pyridin-2-yl-1H-pyrrolo[2,3-c]pyridine-7-carboxylate
SMILESCOC(=O)c1nc(C)cc2c(-c3ccccn3)c[nH]c12
InChIInChI=1S/C15H13N3O2/c1-9-7-10-11(12-5-3-4-6-16-12)8-17-13(10)14(18-9)15(19)20-2/h3-8,17H,1-2H3
InChIKeyNBYKSPLXGZJYET-UHFFFAOYSA-N
XLogP2.72
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 6-methyl-4-pyridin-2-ylquinoline-2-carboxylate
CID 141467624
methyl 3-methyl-4-pyridin-2-ylbenzoate
CID 24829012
methyl 4-hydroxy-3,5-dipyridin-2-ylbenzoate
CID 135496844
methyl 6-bromo-4-pyridin-2-ylquinoline-2-carboxylate
CID 141467629
methyl 2-(2-oxo-3-phenyl-5-pyridin-2-yl-1H-pyridin-4-yl)benzoate
CID 91528400
methyl 3-(2-chloropyrimidin-4-yl)-1H-indole-7-carboxylate
CID 155176377
ethane;6-methyl-3-pyridin-2-ylpyridine-2-carboxylic acid
CID 142536082
6-methyl-3-pyridin-2-ylpyridine-2-carboxamide
CID 175992298
methyl 5-bromo-4-pyridin-2-ylthiophene-2-carboxylate
CID 169144350
methyl 4-methoxy-3-pyridin-2-ylbenzoate
CID 70840507
methyl 3-bromo-1H-pyrrolo[2,3-c]pyridine-7-carboxylate
CID 71472793
dimethyl 6-methyl-4-phenylpyridine-2,3-dicarboxylate
CID 102083837

Frequently Asked Questions

What is the IUPAC name of methyl 5-methyl-3-pyridin-2-yl-1H-pyrrolo[2,3-c]pyridine-7-carboxylate?
The IUPAC name of methyl 5-methyl-3-pyridin-2-yl-1H-pyrrolo[2,3-c]pyridine-7-carboxylate (CID 71472796) is methyl 5-methyl-3-pyridin-2-yl-1H-pyrrolo[2,3-c]pyridine-7-carboxylate.
What is the SMILES notation for methyl 5-methyl-3-pyridin-2-yl-1H-pyrrolo[2,3-c]pyridine-7-carboxylate?
The canonical SMILES for methyl 5-methyl-3-pyridin-2-yl-1H-pyrrolo[2,3-c]pyridine-7-carboxylate is COC(=O)c1nc(C)cc2c(-c3ccccn3)c[nH]c12.
What is the InChIKey of methyl 5-methyl-3-pyridin-2-yl-1H-pyrrolo[2,3-c]pyridine-7-carboxylate?
The InChIKey is NBYKSPLXGZJYET-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O2/c1-9-7-10-11(12-5-3-4-6-16-12)8-17-13(10)14(18-9)15(19)20-2/h3-8,17H,1-2H3.
What are the key properties of methyl 5-methyl-3-pyridin-2-yl-1H-pyrrolo[2,3-c]pyridine-7-carboxylate?
methyl 5-methyl-3-pyridin-2-yl-1H-pyrrolo[2,3-c]pyridine-7-carboxylate has a molecular weight of 267.29 g/mol, XLogP of 2.72, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 5-methyl-3-pyridin-2-yl-1H-pyrrolo[2,3-c]pyridine-7-carboxylate is sourced from PubChem (CID 71472796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).