1-benzofuran-4-yl-[1-(2-morpholin-4-ylethyl)indol-3-yl]methanone

C23H22N2O3 — CID 10407054

IUPAC1-benzofuran-4-yl-[1-(2-morpholin-4-ylethyl)indol-3-yl]methanone
SMILESO=C(c1cccc2occc12)c1cn(CCN2CCOCC2)c2ccccc12
InChIInChI=1S/C23H22N2O3/c26-23(19-5-3-7-22-18(19)8-13-28-22)20-16-25(21-6-2-1-4-17(20)21)10-9-24-11-14-27-15-12-24/h1-8,13,16H,9-12,14-15H2
InChIKeyLRPQPXKQXRDYRD-UHFFFAOYSA-N
MW374.44 g/mol
LogP3.95
Rot. Bonds5

About 1-benzofuran-4-yl-[1-(2-morpholin-4-ylethyl)indol-3-yl]methanone

1-benzofuran-4-yl-[1-(2-morpholin-4-ylethyl)indol-3-yl]methanone (PubChem CID 10407054) has the molecular formula C23H22N2O3 and a molecular weight of 374.44 g/mol. Its IUPAC name is 1-benzofuran-4-yl-[1-(2-morpholin-4-ylethyl)indol-3-yl]methanone.

Molecular Properties

Compound Name1-benzofuran-4-yl-[1-(2-morpholin-4-ylethyl)indol-3-yl]methanone
PubChem CID10407054
Molecular FormulaC23H22N2O3
Molecular Weight374.44 g/mol
Exact Mass374.16
IUPAC Name1-benzofuran-4-yl-[1-(2-morpholin-4-ylethyl)indol-3-yl]methanone
SMILESO=C(c1cccc2occc12)c1cn(CCN2CCOCC2)c2ccccc12
InChIInChI=1S/C23H22N2O3/c26-23(19-5-3-7-22-18(19)8-13-28-22)20-16-25(21-6-2-1-4-17(20)21)10-9-24-11-14-27-15-12-24/h1-8,13,16H,9-12,14-15H2
InChIKeyLRPQPXKQXRDYRD-UHFFFAOYSA-N
XLogP3.95
TPSA47.61 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.44
LogP ≤ 53.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-benzofuran-4-yl-[1-(2-morpholin-4-ylethyl)indol-3-yl]methanone?
The IUPAC name of 1-benzofuran-4-yl-[1-(2-morpholin-4-ylethyl)indol-3-yl]methanone (CID 10407054) is 1-benzofuran-4-yl-[1-(2-morpholin-4-ylethyl)indol-3-yl]methanone.
What is the SMILES notation for 1-benzofuran-4-yl-[1-(2-morpholin-4-ylethyl)indol-3-yl]methanone?
The canonical SMILES for 1-benzofuran-4-yl-[1-(2-morpholin-4-ylethyl)indol-3-yl]methanone is O=C(c1cccc2occc12)c1cn(CCN2CCOCC2)c2ccccc12.
What is the InChIKey of 1-benzofuran-4-yl-[1-(2-morpholin-4-ylethyl)indol-3-yl]methanone?
The InChIKey is LRPQPXKQXRDYRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N2O3/c26-23(19-5-3-7-22-18(19)8-13-28-22)20-16-25(21-6-2-1-4-17(20)21)10-9-24-11-14-27-15-12-24/h1-8,13,16H,9-12,14-15H2.
What are the key properties of 1-benzofuran-4-yl-[1-(2-morpholin-4-ylethyl)indol-3-yl]methanone?
1-benzofuran-4-yl-[1-(2-morpholin-4-ylethyl)indol-3-yl]methanone has a molecular weight of 374.44 g/mol, XLogP of 3.95, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzofuran-4-yl-[1-(2-morpholin-4-ylethyl)indol-3-yl]methanone is sourced from PubChem (CID 10407054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).