3-(1-ethylindol-3-yl)-N-(2-phenylethyl)propanamide

C21H24N2O — CID 20899797

IUPAC3-(1-ethylindol-3-yl)-N-(2-phenylethyl)propanamide
SMILESCCn1cc(CCC(=O)NCCc2ccccc2)c2ccccc21
InChIInChI=1S/C21H24N2O/c1-2-23-16-18(19-10-6-7-11-20(19)23)12-13-21(24)22-15-14-17-8-4-3-5-9-17/h3-11,16H,2,12-15H2,1H3,(H,22,24)
InChIKeyAKERAMVEVWUTAM-UHFFFAOYSA-N
MW320.44 g/mol
LogP3.95
Rot. Bonds7

About 3-(1-ethylindol-3-yl)-N-(2-phenylethyl)propanamide

3-(1-ethylindol-3-yl)-N-(2-phenylethyl)propanamide (PubChem CID 20899797) has the molecular formula C21H24N2O and a molecular weight of 320.44 g/mol. Its IUPAC name is 3-(1-ethylindol-3-yl)-N-(2-phenylethyl)propanamide.

Molecular Properties

Compound Name3-(1-ethylindol-3-yl)-N-(2-phenylethyl)propanamide
PubChem CID20899797
Molecular FormulaC21H24N2O
Molecular Weight320.44 g/mol
Exact Mass320.19
IUPAC Name3-(1-ethylindol-3-yl)-N-(2-phenylethyl)propanamide
SMILESCCn1cc(CCC(=O)NCCc2ccccc2)c2ccccc21
InChIInChI=1S/C21H24N2O/c1-2-23-16-18(19-10-6-7-11-20(19)23)12-13-21(24)22-15-14-17-8-4-3-5-9-17/h3-11,16H,2,12-15H2,1H3,(H,22,24)
InChIKeyAKERAMVEVWUTAM-UHFFFAOYSA-N
XLogP3.95
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.44
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(1-ethylindol-3-yl)-N-(2-phenylethyl)propanamide?
The IUPAC name of 3-(1-ethylindol-3-yl)-N-(2-phenylethyl)propanamide (CID 20899797) is 3-(1-ethylindol-3-yl)-N-(2-phenylethyl)propanamide.
What is the SMILES notation for 3-(1-ethylindol-3-yl)-N-(2-phenylethyl)propanamide?
The canonical SMILES for 3-(1-ethylindol-3-yl)-N-(2-phenylethyl)propanamide is CCn1cc(CCC(=O)NCCc2ccccc2)c2ccccc21.
What is the InChIKey of 3-(1-ethylindol-3-yl)-N-(2-phenylethyl)propanamide?
The InChIKey is AKERAMVEVWUTAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O/c1-2-23-16-18(19-10-6-7-11-20(19)23)12-13-21(24)22-15-14-17-8-4-3-5-9-17/h3-11,16H,2,12-15H2,1H3,(H,22,24).
What are the key properties of 3-(1-ethylindol-3-yl)-N-(2-phenylethyl)propanamide?
3-(1-ethylindol-3-yl)-N-(2-phenylethyl)propanamide has a molecular weight of 320.44 g/mol, XLogP of 3.95, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-ethylindol-3-yl)-N-(2-phenylethyl)propanamide is sourced from PubChem (CID 20899797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).