3-[furan-2-yl-(1-methylindol-3-yl)methyl]-1-methylindole

C23H20N2O — CID 2944205

IUPAC3-[furan-2-yl-(1-methylindol-3-yl)methyl]-1-methylindole
SMILESCn1cc(C(c2ccco2)c2cn(C)c3ccccc23)c2ccccc21
InChIInChI=1S/C23H20N2O/c1-24-14-18(16-8-3-5-10-20(16)24)23(22-12-7-13-26-22)19-15-25(2)21-11-6-4-9-17(19)21/h3-15,23H,1-2H3
InChIKeyGBMCVPPDGOYIJU-UHFFFAOYSA-N
MW340.43 g/mol
LogP5.44
Rot. Bonds3

About 3-[furan-2-yl-(1-methylindol-3-yl)methyl]-1-methylindole

3-[furan-2-yl-(1-methylindol-3-yl)methyl]-1-methylindole (PubChem CID 2944205) has the molecular formula C23H20N2O and a molecular weight of 340.43 g/mol. Its IUPAC name is 3-[furan-2-yl-(1-methylindol-3-yl)methyl]-1-methylindole.

Molecular Properties

Compound Name3-[furan-2-yl-(1-methylindol-3-yl)methyl]-1-methylindole
PubChem CID2944205
Molecular FormulaC23H20N2O
Molecular Weight340.43 g/mol
Exact Mass340.16
IUPAC Name3-[furan-2-yl-(1-methylindol-3-yl)methyl]-1-methylindole
SMILESCn1cc(C(c2ccco2)c2cn(C)c3ccccc23)c2ccccc21
InChIInChI=1S/C23H20N2O/c1-24-14-18(16-8-3-5-10-20(16)24)23(22-12-7-13-26-22)19-15-25(2)21-11-6-4-9-17(19)21/h3-15,23H,1-2H3
InChIKeyGBMCVPPDGOYIJU-UHFFFAOYSA-N
XLogP5.44
TPSA23.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500340.43
LogP ≤ 55.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[furan-2-yl-(1-methylindol-3-yl)methyl]-1-methylindole?
The IUPAC name of 3-[furan-2-yl-(1-methylindol-3-yl)methyl]-1-methylindole (CID 2944205) is 3-[furan-2-yl-(1-methylindol-3-yl)methyl]-1-methylindole.
What is the SMILES notation for 3-[furan-2-yl-(1-methylindol-3-yl)methyl]-1-methylindole?
The canonical SMILES for 3-[furan-2-yl-(1-methylindol-3-yl)methyl]-1-methylindole is Cn1cc(C(c2ccco2)c2cn(C)c3ccccc23)c2ccccc21.
What is the InChIKey of 3-[furan-2-yl-(1-methylindol-3-yl)methyl]-1-methylindole?
The InChIKey is GBMCVPPDGOYIJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2O/c1-24-14-18(16-8-3-5-10-20(16)24)23(22-12-7-13-26-22)19-15-25(2)21-11-6-4-9-17(19)21/h3-15,23H,1-2H3.
What are the key properties of 3-[furan-2-yl-(1-methylindol-3-yl)methyl]-1-methylindole?
3-[furan-2-yl-(1-methylindol-3-yl)methyl]-1-methylindole has a molecular weight of 340.43 g/mol, XLogP of 5.44, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[furan-2-yl-(1-methylindol-3-yl)methyl]-1-methylindole is sourced from PubChem (CID 2944205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).