5-methoxy-3-[5-(5-methoxy-1-methylindol-3-yl)furan-2-yl]-1-methylindole

C24H22N2O3 — CID 45028187

IUPAC5-methoxy-3-[5-(5-methoxy-1-methylindol-3-yl)furan-2-yl]-1-methylindole
SMILESCOc1ccc2c(c1)c(-c1ccc(-c3cn(C)c4ccc(OC)cc34)o1)cn2C
InChIInChI=1S/C24H22N2O3/c1-25-13-19(17-11-15(27-3)5-7-21(17)25)23-9-10-24(29-23)20-14-26(2)22-8-6-16(28-4)12-18(20)22/h5-14H,1-4H3
InChIKeyHSGZDGBPDNLOFS-UHFFFAOYSA-N
MW386.45 g/mol
LogP5.61
Rot. Bonds4

About 5-methoxy-3-[5-(5-methoxy-1-methylindol-3-yl)furan-2-yl]-1-methylindole

5-methoxy-3-[5-(5-methoxy-1-methylindol-3-yl)furan-2-yl]-1-methylindole (PubChem CID 45028187) has the molecular formula C24H22N2O3 and a molecular weight of 386.45 g/mol. Its IUPAC name is 5-methoxy-3-[5-(5-methoxy-1-methylindol-3-yl)furan-2-yl]-1-methylindole.

Molecular Properties

Compound Name5-methoxy-3-[5-(5-methoxy-1-methylindol-3-yl)furan-2-yl]-1-methylindole
PubChem CID45028187
Molecular FormulaC24H22N2O3
Molecular Weight386.45 g/mol
Exact Mass386.16
IUPAC Name5-methoxy-3-[5-(5-methoxy-1-methylindol-3-yl)furan-2-yl]-1-methylindole
SMILESCOc1ccc2c(c1)c(-c1ccc(-c3cn(C)c4ccc(OC)cc34)o1)cn2C
InChIInChI=1S/C24H22N2O3/c1-25-13-19(17-11-15(27-3)5-7-21(17)25)23-9-10-24(29-23)20-14-26(2)22-8-6-16(28-4)12-18(20)22/h5-14H,1-4H3
InChIKeyHSGZDGBPDNLOFS-UHFFFAOYSA-N
XLogP5.61
TPSA41.46 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500386.45
LogP ≤ 55.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-3-[5-(5-methoxy-1-methylindol-3-yl)furan-2-yl]-1-methylindole?
The IUPAC name of 5-methoxy-3-[5-(5-methoxy-1-methylindol-3-yl)furan-2-yl]-1-methylindole (CID 45028187) is 5-methoxy-3-[5-(5-methoxy-1-methylindol-3-yl)furan-2-yl]-1-methylindole.
What is the SMILES notation for 5-methoxy-3-[5-(5-methoxy-1-methylindol-3-yl)furan-2-yl]-1-methylindole?
The canonical SMILES for 5-methoxy-3-[5-(5-methoxy-1-methylindol-3-yl)furan-2-yl]-1-methylindole is COc1ccc2c(c1)c(-c1ccc(-c3cn(C)c4ccc(OC)cc34)o1)cn2C.
What is the InChIKey of 5-methoxy-3-[5-(5-methoxy-1-methylindol-3-yl)furan-2-yl]-1-methylindole?
The InChIKey is HSGZDGBPDNLOFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N2O3/c1-25-13-19(17-11-15(27-3)5-7-21(17)25)23-9-10-24(29-23)20-14-26(2)22-8-6-16(28-4)12-18(20)22/h5-14H,1-4H3.
What are the key properties of 5-methoxy-3-[5-(5-methoxy-1-methylindol-3-yl)furan-2-yl]-1-methylindole?
5-methoxy-3-[5-(5-methoxy-1-methylindol-3-yl)furan-2-yl]-1-methylindole has a molecular weight of 386.45 g/mol, XLogP of 5.61, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-3-[5-(5-methoxy-1-methylindol-3-yl)furan-2-yl]-1-methylindole is sourced from PubChem (CID 45028187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).