6-(furan-2-yl)-2-[(4-methoxy-3-methylphenyl)methyl]-1H-imidazo[4,5-b]pyridine

C19H17N3O2 — CID 23025688

IUPAC6-(furan-2-yl)-2-[(4-methoxy-3-methylphenyl)methyl]-1H-imidazo[4,5-b]pyridine
SMILESCOc1ccc(Cc2nc3ncc(-c4ccco4)cc3[nH]2)cc1C
InChIInChI=1S/C19H17N3O2/c1-12-8-13(5-6-16(12)23-2)9-18-21-15-10-14(11-20-19(15)22-18)17-4-3-7-24-17/h3-8,10-11H,9H2,1-2H3,(H,20,21,22)
InChIKeyDDPZJUMFHYFTPW-UHFFFAOYSA-N
MW319.36 g/mol
LogP4.13
Rot. Bonds4

About 6-(furan-2-yl)-2-[(4-methoxy-3-methylphenyl)methyl]-1H-imidazo[4,5-b]pyridine

6-(furan-2-yl)-2-[(4-methoxy-3-methylphenyl)methyl]-1H-imidazo[4,5-b]pyridine (PubChem CID 23025688) has the molecular formula C19H17N3O2 and a molecular weight of 319.36 g/mol. Its IUPAC name is 6-(furan-2-yl)-2-[(4-methoxy-3-methylphenyl)methyl]-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name6-(furan-2-yl)-2-[(4-methoxy-3-methylphenyl)methyl]-1H-imidazo[4,5-b]pyridine
PubChem CID23025688
Molecular FormulaC19H17N3O2
Molecular Weight319.36 g/mol
Exact Mass319.13
IUPAC Name6-(furan-2-yl)-2-[(4-methoxy-3-methylphenyl)methyl]-1H-imidazo[4,5-b]pyridine
SMILESCOc1ccc(Cc2nc3ncc(-c4ccco4)cc3[nH]2)cc1C
InChIInChI=1S/C19H17N3O2/c1-12-8-13(5-6-16(12)23-2)9-18-21-15-10-14(11-20-19(15)22-18)17-4-3-7-24-17/h3-8,10-11H,9H2,1-2H3,(H,20,21,22)
InChIKeyDDPZJUMFHYFTPW-UHFFFAOYSA-N
XLogP4.13
TPSA63.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.36
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(furan-2-yl)-2-[(4-methoxy-3-methylphenyl)methyl]-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 6-(furan-2-yl)-2-[(4-methoxy-3-methylphenyl)methyl]-1H-imidazo[4,5-b]pyridine (CID 23025688) is 6-(furan-2-yl)-2-[(4-methoxy-3-methylphenyl)methyl]-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 6-(furan-2-yl)-2-[(4-methoxy-3-methylphenyl)methyl]-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 6-(furan-2-yl)-2-[(4-methoxy-3-methylphenyl)methyl]-1H-imidazo[4,5-b]pyridine is COc1ccc(Cc2nc3ncc(-c4ccco4)cc3[nH]2)cc1C.
What is the InChIKey of 6-(furan-2-yl)-2-[(4-methoxy-3-methylphenyl)methyl]-1H-imidazo[4,5-b]pyridine?
The InChIKey is DDPZJUMFHYFTPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O2/c1-12-8-13(5-6-16(12)23-2)9-18-21-15-10-14(11-20-19(15)22-18)17-4-3-7-24-17/h3-8,10-11H,9H2,1-2H3,(H,20,21,22).
What are the key properties of 6-(furan-2-yl)-2-[(4-methoxy-3-methylphenyl)methyl]-1H-imidazo[4,5-b]pyridine?
6-(furan-2-yl)-2-[(4-methoxy-3-methylphenyl)methyl]-1H-imidazo[4,5-b]pyridine has a molecular weight of 319.36 g/mol, XLogP of 4.13, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(furan-2-yl)-2-[(4-methoxy-3-methylphenyl)methyl]-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 23025688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).