1-[3-(5-ethylfuran-2-yl)morpholin-4-yl]-2-(5-fluoro-1H-indol-3-yl)ethanone

C20H21FN2O3 — CID 139002397

IUPAC1-[3-(5-ethylfuran-2-yl)morpholin-4-yl]-2-(5-fluoro-1H-indol-3-yl)ethanone
SMILESCCc1ccc(C2COCCN2C(=O)Cc2c[nH]c3ccc(F)cc23)o1
InChIInChI=1S/C20H21FN2O3/c1-2-15-4-6-19(26-15)18-12-25-8-7-23(18)20(24)9-13-11-22-17-5-3-14(21)10-16(13)17/h3-6,10-11,18,22H,2,7-9,12H2,1H3
InChIKeyVIZHTYCSVARPOB-UHFFFAOYSA-N
MW356.40 g/mol
LogP3.61
Rot. Bonds4

About 1-[3-(5-ethylfuran-2-yl)morpholin-4-yl]-2-(5-fluoro-1H-indol-3-yl)ethanone

1-[3-(5-ethylfuran-2-yl)morpholin-4-yl]-2-(5-fluoro-1H-indol-3-yl)ethanone (PubChem CID 139002397) has the molecular formula C20H21FN2O3 and a molecular weight of 356.40 g/mol. Its IUPAC name is 1-[3-(5-ethylfuran-2-yl)morpholin-4-yl]-2-(5-fluoro-1H-indol-3-yl)ethanone.

Molecular Properties

Compound Name1-[3-(5-ethylfuran-2-yl)morpholin-4-yl]-2-(5-fluoro-1H-indol-3-yl)ethanone
PubChem CID139002397
Molecular FormulaC20H21FN2O3
Molecular Weight356.40 g/mol
Exact Mass356.15
IUPAC Name1-[3-(5-ethylfuran-2-yl)morpholin-4-yl]-2-(5-fluoro-1H-indol-3-yl)ethanone
SMILESCCc1ccc(C2COCCN2C(=O)Cc2c[nH]c3ccc(F)cc23)o1
InChIInChI=1S/C20H21FN2O3/c1-2-15-4-6-19(26-15)18-12-25-8-7-23(18)20(24)9-13-11-22-17-5-3-14(21)10-16(13)17/h3-6,10-11,18,22H,2,7-9,12H2,1H3
InChIKeyVIZHTYCSVARPOB-UHFFFAOYSA-N
XLogP3.61
TPSA58.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.40
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[3-(5-ethylfuran-2-yl)morpholin-4-yl]-2-(5-fluoro-1H-indol-3-yl)ethanone?
The IUPAC name of 1-[3-(5-ethylfuran-2-yl)morpholin-4-yl]-2-(5-fluoro-1H-indol-3-yl)ethanone (CID 139002397) is 1-[3-(5-ethylfuran-2-yl)morpholin-4-yl]-2-(5-fluoro-1H-indol-3-yl)ethanone.
What is the SMILES notation for 1-[3-(5-ethylfuran-2-yl)morpholin-4-yl]-2-(5-fluoro-1H-indol-3-yl)ethanone?
The canonical SMILES for 1-[3-(5-ethylfuran-2-yl)morpholin-4-yl]-2-(5-fluoro-1H-indol-3-yl)ethanone is CCc1ccc(C2COCCN2C(=O)Cc2c[nH]c3ccc(F)cc23)o1.
What is the InChIKey of 1-[3-(5-ethylfuran-2-yl)morpholin-4-yl]-2-(5-fluoro-1H-indol-3-yl)ethanone?
The InChIKey is VIZHTYCSVARPOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21FN2O3/c1-2-15-4-6-19(26-15)18-12-25-8-7-23(18)20(24)9-13-11-22-17-5-3-14(21)10-16(13)17/h3-6,10-11,18,22H,2,7-9,12H2,1H3.
What are the key properties of 1-[3-(5-ethylfuran-2-yl)morpholin-4-yl]-2-(5-fluoro-1H-indol-3-yl)ethanone?
1-[3-(5-ethylfuran-2-yl)morpholin-4-yl]-2-(5-fluoro-1H-indol-3-yl)ethanone has a molecular weight of 356.40 g/mol, XLogP of 3.61, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(5-ethylfuran-2-yl)morpholin-4-yl]-2-(5-fluoro-1H-indol-3-yl)ethanone is sourced from PubChem (CID 139002397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).