4-(furan-2-yl)-1-[(4-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine

C19H16N2O2 — CID 56681910

IUPAC4-(furan-2-yl)-1-[(4-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine
SMILESCOc1ccc(Cn2ccc3c(-c4ccco4)ccnc32)cc1
InChIInChI=1S/C19H16N2O2/c1-22-15-6-4-14(5-7-15)13-21-11-9-17-16(8-10-20-19(17)21)18-3-2-12-23-18/h2-12H,13H2,1H3
InChIKeyXIXJNBIIYYLDDV-UHFFFAOYSA-N
MW304.35 g/mol
LogP4.35
Rot. Bonds4

About 4-(furan-2-yl)-1-[(4-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine

4-(furan-2-yl)-1-[(4-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine (PubChem CID 56681910) has the molecular formula C19H16N2O2 and a molecular weight of 304.35 g/mol. Its IUPAC name is 4-(furan-2-yl)-1-[(4-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Name4-(furan-2-yl)-1-[(4-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine
PubChem CID56681910
Molecular FormulaC19H16N2O2
Molecular Weight304.35 g/mol
Exact Mass304.12
IUPAC Name4-(furan-2-yl)-1-[(4-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine
SMILESCOc1ccc(Cn2ccc3c(-c4ccco4)ccnc32)cc1
InChIInChI=1S/C19H16N2O2/c1-22-15-6-4-14(5-7-15)13-21-11-9-17-16(8-10-20-19(17)21)18-3-2-12-23-18/h2-12H,13H2,1H3
InChIKeyXIXJNBIIYYLDDV-UHFFFAOYSA-N
XLogP4.35
TPSA40.19 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(furan-2-yl)-1-[(4-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine?
The IUPAC name of 4-(furan-2-yl)-1-[(4-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine (CID 56681910) is 4-(furan-2-yl)-1-[(4-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine.
What is the SMILES notation for 4-(furan-2-yl)-1-[(4-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine?
The canonical SMILES for 4-(furan-2-yl)-1-[(4-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine is COc1ccc(Cn2ccc3c(-c4ccco4)ccnc32)cc1.
What is the InChIKey of 4-(furan-2-yl)-1-[(4-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine?
The InChIKey is XIXJNBIIYYLDDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O2/c1-22-15-6-4-14(5-7-15)13-21-11-9-17-16(8-10-20-19(17)21)18-3-2-12-23-18/h2-12H,13H2,1H3.
What are the key properties of 4-(furan-2-yl)-1-[(4-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine?
4-(furan-2-yl)-1-[(4-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine has a molecular weight of 304.35 g/mol, XLogP of 4.35, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(furan-2-yl)-1-[(4-methoxyphenyl)methyl]pyrrolo[2,3-b]pyridine is sourced from PubChem (CID 56681910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).