2-(2,3-dihydro-1-benzofuran-2-yl)-7-methyl-1H-imidazo[4,5-b]pyridine

C15H13N3O — CID 63723670

IUPAC2-(2,3-dihydro-1-benzofuran-2-yl)-7-methyl-1H-imidazo[4,5-b]pyridine
SMILESCc1ccnc2nc(C3Cc4ccccc4O3)[nH]c12
InChIInChI=1S/C15H13N3O/c1-9-6-7-16-15-13(9)17-14(18-15)12-8-10-4-2-3-5-11(10)19-12/h2-7,12H,8H2,1H3,(H,16,17,18)
InChIKeyUNSKKDXKTMTPOQ-UHFFFAOYSA-N
MW251.29 g/mol
LogP2.94
Rot. Bonds1

About 2-(2,3-dihydro-1-benzofuran-2-yl)-7-methyl-1H-imidazo[4,5-b]pyridine

2-(2,3-dihydro-1-benzofuran-2-yl)-7-methyl-1H-imidazo[4,5-b]pyridine (PubChem CID 63723670) has the molecular formula C15H13N3O and a molecular weight of 251.29 g/mol. Its IUPAC name is 2-(2,3-dihydro-1-benzofuran-2-yl)-7-methyl-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-(2,3-dihydro-1-benzofuran-2-yl)-7-methyl-1H-imidazo[4,5-b]pyridine
PubChem CID63723670
Molecular FormulaC15H13N3O
Molecular Weight251.29 g/mol
Exact Mass251.11
IUPAC Name2-(2,3-dihydro-1-benzofuran-2-yl)-7-methyl-1H-imidazo[4,5-b]pyridine
SMILESCc1ccnc2nc(C3Cc4ccccc4O3)[nH]c12
InChIInChI=1S/C15H13N3O/c1-9-6-7-16-15-13(9)17-14(18-15)12-8-10-4-2-3-5-11(10)19-12/h2-7,12H,8H2,1H3,(H,16,17,18)
InChIKeyUNSKKDXKTMTPOQ-UHFFFAOYSA-N
XLogP2.94
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1-benzofuran-2-yl)-7-methyl-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 2-(2,3-dihydro-1-benzofuran-2-yl)-7-methyl-1H-imidazo[4,5-b]pyridine (CID 63723670) is 2-(2,3-dihydro-1-benzofuran-2-yl)-7-methyl-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-(2,3-dihydro-1-benzofuran-2-yl)-7-methyl-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 2-(2,3-dihydro-1-benzofuran-2-yl)-7-methyl-1H-imidazo[4,5-b]pyridine is Cc1ccnc2nc(C3Cc4ccccc4O3)[nH]c12.
What is the InChIKey of 2-(2,3-dihydro-1-benzofuran-2-yl)-7-methyl-1H-imidazo[4,5-b]pyridine?
The InChIKey is UNSKKDXKTMTPOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O/c1-9-6-7-16-15-13(9)17-14(18-15)12-8-10-4-2-3-5-11(10)19-12/h2-7,12H,8H2,1H3,(H,16,17,18).
What are the key properties of 2-(2,3-dihydro-1-benzofuran-2-yl)-7-methyl-1H-imidazo[4,5-b]pyridine?
2-(2,3-dihydro-1-benzofuran-2-yl)-7-methyl-1H-imidazo[4,5-b]pyridine has a molecular weight of 251.29 g/mol, XLogP of 2.94, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1-benzofuran-2-yl)-7-methyl-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 63723670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).