[1-(2-morpholin-4-ylethyl)indol-3-yl]-quinolin-6-ylmethanone

C24H23N3O2 — CID 10452672

IUPAC[1-(2-morpholin-4-ylethyl)indol-3-yl]-quinolin-6-ylmethanone
SMILESO=C(c1ccc2ncccc2c1)c1cn(CCN2CCOCC2)c2ccccc12
InChIInChI=1S/C24H23N3O2/c28-24(19-7-8-22-18(16-19)4-3-9-25-22)21-17-27(23-6-2-1-5-20(21)23)11-10-26-12-14-29-15-13-26/h1-9,16-17H,10-15H2
InChIKeyKUMZSRGMBGBYSD-UHFFFAOYSA-N
MW385.47 g/mol
LogP3.75
Rot. Bonds5

About [1-(2-morpholin-4-ylethyl)indol-3-yl]-quinolin-6-ylmethanone

[1-(2-morpholin-4-ylethyl)indol-3-yl]-quinolin-6-ylmethanone (PubChem CID 10452672) has the molecular formula C24H23N3O2 and a molecular weight of 385.47 g/mol. Its IUPAC name is [1-(2-morpholin-4-ylethyl)indol-3-yl]-quinolin-6-ylmethanone.

Molecular Properties

Compound Name[1-(2-morpholin-4-ylethyl)indol-3-yl]-quinolin-6-ylmethanone
PubChem CID10452672
Molecular FormulaC24H23N3O2
Molecular Weight385.47 g/mol
Exact Mass385.18
IUPAC Name[1-(2-morpholin-4-ylethyl)indol-3-yl]-quinolin-6-ylmethanone
SMILESO=C(c1ccc2ncccc2c1)c1cn(CCN2CCOCC2)c2ccccc12
InChIInChI=1S/C24H23N3O2/c28-24(19-7-8-22-18(16-19)4-3-9-25-22)21-17-27(23-6-2-1-5-20(21)23)11-10-26-12-14-29-15-13-26/h1-9,16-17H,10-15H2
InChIKeyKUMZSRGMBGBYSD-UHFFFAOYSA-N
XLogP3.75
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.47
LogP ≤ 53.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [1-(2-morpholin-4-ylethyl)indol-3-yl]-quinolin-6-ylmethanone?
The IUPAC name of [1-(2-morpholin-4-ylethyl)indol-3-yl]-quinolin-6-ylmethanone (CID 10452672) is [1-(2-morpholin-4-ylethyl)indol-3-yl]-quinolin-6-ylmethanone.
What is the SMILES notation for [1-(2-morpholin-4-ylethyl)indol-3-yl]-quinolin-6-ylmethanone?
The canonical SMILES for [1-(2-morpholin-4-ylethyl)indol-3-yl]-quinolin-6-ylmethanone is O=C(c1ccc2ncccc2c1)c1cn(CCN2CCOCC2)c2ccccc12.
What is the InChIKey of [1-(2-morpholin-4-ylethyl)indol-3-yl]-quinolin-6-ylmethanone?
The InChIKey is KUMZSRGMBGBYSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O2/c28-24(19-7-8-22-18(16-19)4-3-9-25-22)21-17-27(23-6-2-1-5-20(21)23)11-10-26-12-14-29-15-13-26/h1-9,16-17H,10-15H2.
What are the key properties of [1-(2-morpholin-4-ylethyl)indol-3-yl]-quinolin-6-ylmethanone?
[1-(2-morpholin-4-ylethyl)indol-3-yl]-quinolin-6-ylmethanone has a molecular weight of 385.47 g/mol, XLogP of 3.75, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-morpholin-4-ylethyl)indol-3-yl]-quinolin-6-ylmethanone is sourced from PubChem (CID 10452672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).