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

C25H24N2O2 — CID 10045570

IUPAC[1-(2-morpholin-4-ylethyl)indol-3-yl]-naphthalen-1-ylmethanone
SMILESO=C(c1cccc2ccccc12)c1cn(CCN2CCOCC2)c2ccccc12
InChIInChI=1S/C25H24N2O2/c28-25(22-10-5-7-19-6-1-2-8-20(19)22)23-18-27(24-11-4-3-9-21(23)24)13-12-26-14-16-29-17-15-26/h1-11,18H,12-17H2
InChIKeySZWYXJHTNGJPKU-UHFFFAOYSA-N
MW384.48 g/mol
LogP4.36
Rot. Bonds5

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

[1-(2-morpholin-4-ylethyl)indol-3-yl]-naphthalen-1-ylmethanone (PubChem CID 10045570) has the molecular formula C25H24N2O2 and a molecular weight of 384.48 g/mol. Its IUPAC name is [1-(2-morpholin-4-ylethyl)indol-3-yl]-naphthalen-1-ylmethanone.

Molecular Properties

Compound Name[1-(2-morpholin-4-ylethyl)indol-3-yl]-naphthalen-1-ylmethanone
PubChem CID10045570
Molecular FormulaC25H24N2O2
Molecular Weight384.48 g/mol
Exact Mass384.18
IUPAC Name[1-(2-morpholin-4-ylethyl)indol-3-yl]-naphthalen-1-ylmethanone
SMILESO=C(c1cccc2ccccc12)c1cn(CCN2CCOCC2)c2ccccc12
InChIInChI=1S/C25H24N2O2/c28-25(22-10-5-7-19-6-1-2-8-20(19)22)23-18-27(24-11-4-3-9-21(23)24)13-12-26-14-16-29-17-15-26/h1-11,18H,12-17H2
InChIKeySZWYXJHTNGJPKU-UHFFFAOYSA-N
XLogP4.36
TPSA34.47 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.48
LogP ≤ 54.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [1-(2-morpholin-4-ylethyl)indol-3-yl]-naphthalen-1-ylmethanone?
The IUPAC name of [1-(2-morpholin-4-ylethyl)indol-3-yl]-naphthalen-1-ylmethanone (CID 10045570) is [1-(2-morpholin-4-ylethyl)indol-3-yl]-naphthalen-1-ylmethanone.
What is the SMILES notation for [1-(2-morpholin-4-ylethyl)indol-3-yl]-naphthalen-1-ylmethanone?
The canonical SMILES for [1-(2-morpholin-4-ylethyl)indol-3-yl]-naphthalen-1-ylmethanone is O=C(c1cccc2ccccc12)c1cn(CCN2CCOCC2)c2ccccc12.
What is the InChIKey of [1-(2-morpholin-4-ylethyl)indol-3-yl]-naphthalen-1-ylmethanone?
The InChIKey is SZWYXJHTNGJPKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N2O2/c28-25(22-10-5-7-19-6-1-2-8-20(19)22)23-18-27(24-11-4-3-9-21(23)24)13-12-26-14-16-29-17-15-26/h1-11,18H,12-17H2.
What are the key properties of [1-(2-morpholin-4-ylethyl)indol-3-yl]-naphthalen-1-ylmethanone?
[1-(2-morpholin-4-ylethyl)indol-3-yl]-naphthalen-1-ylmethanone has a molecular weight of 384.48 g/mol, XLogP of 4.36, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-morpholin-4-ylethyl)indol-3-yl]-naphthalen-1-ylmethanone is sourced from PubChem (CID 10045570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).