2-(3-fluoro-4-phenylphenyl)-N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]propanamide

C25H23FN2O2 — CID 118723549

IUPAC2-(3-fluoro-4-phenylphenyl)-N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]propanamide
SMILESCC(C(=O)NCCc1c[nH]c2ccc(O)cc12)c1ccc(-c2ccccc2)c(F)c1
InChIInChI=1S/C25H23FN2O2/c1-16(18-7-9-21(23(26)13-18)17-5-3-2-4-6-17)25(30)27-12-11-19-15-28-24-10-8-20(29)14-22(19)24/h2-10,13-16,28-29H,11-12H2,1H3,(H,27,30)
InChIKeyRWRSAYHAZBVTII-UHFFFAOYSA-N
MW402.47 g/mol
LogP5.14
Rot. Bonds6

About 2-(3-fluoro-4-phenylphenyl)-N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]propanamide

2-(3-fluoro-4-phenylphenyl)-N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]propanamide (PubChem CID 118723549) has the molecular formula C25H23FN2O2 and a molecular weight of 402.47 g/mol. Its IUPAC name is 2-(3-fluoro-4-phenylphenyl)-N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]propanamide.

Molecular Properties

Compound Name2-(3-fluoro-4-phenylphenyl)-N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]propanamide
PubChem CID118723549
Molecular FormulaC25H23FN2O2
Molecular Weight402.47 g/mol
Exact Mass402.17
IUPAC Name2-(3-fluoro-4-phenylphenyl)-N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]propanamide
SMILESCC(C(=O)NCCc1c[nH]c2ccc(O)cc12)c1ccc(-c2ccccc2)c(F)c1
InChIInChI=1S/C25H23FN2O2/c1-16(18-7-9-21(23(26)13-18)17-5-3-2-4-6-17)25(30)27-12-11-19-15-28-24-10-8-20(29)14-22(19)24/h2-10,13-16,28-29H,11-12H2,1H3,(H,27,30)
InChIKeyRWRSAYHAZBVTII-UHFFFAOYSA-N
XLogP5.14
TPSA65.12 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500402.47
LogP ≤ 55.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Analyze 2-(3-fluoro-4-phenylphenyl)-N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-2-amino-5-[2-(5-hydroxy-1H-indol-3-yl)ethylamino]-5-oxopentanoic acid
CID 15234236
N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]-2,2,4-trimethylpentanamide
CID 143884091
2-[(2,4-dihydroxyphenyl)methyl]-4-hydroxy-N-[2-(1H-indol-3-yl)ethyl]butanamide
CID 72705410
2-amino-N-[2-[[2-[2-(5-hydroxy-1H-indol-3-yl)ethylamino]-2-oxoethyl]amino]-2-oxoethyl]acetamide
CID 3344323
N-[3-(5-hydroxy-1H-indol-3-yl)propyl]benzamide
CID 18360710
2-fluoro-N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]pyridine-3-carboxamide
CID 168786739
(2R)-2-(3-fluoro-4-phenylphenyl)-N-[3-[3-[[4-[3-[3-[[(2R)-2-(3-fluoro-4-phenylphenyl)propanoyl]amino]propylamino]propylamino]-3,6-dioxocyclohexa-1,4-dien-1-yl]amino]propylamino]propyl]propanamide
CID 72545286
3-(5-hydroxy-1H-indol-3-yl)-N,2-dimethylpropanamide
CID 166672970
5-chloro-2-(3-fluoro-4-phenylphenyl)hexan-3-one
CID 143928439
[2-[2-(5-hydroxy-1H-indol-3-yl)ethylcarbamoyl]phenyl] acetate
CID 118723540
4-[2-(1H-indol-3-yl)ethylamino]-2,3-dimethyl-4-oxobutanoic acid
CID 103496413
sodium;carbonic acid;2-(3-fluoro-4-phenylphenyl)propanoic acid;hydride
CID 173161937

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluoro-4-phenylphenyl)-N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]propanamide?
The IUPAC name of 2-(3-fluoro-4-phenylphenyl)-N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]propanamide (CID 118723549) is 2-(3-fluoro-4-phenylphenyl)-N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]propanamide.
What is the SMILES notation for 2-(3-fluoro-4-phenylphenyl)-N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]propanamide?
The canonical SMILES for 2-(3-fluoro-4-phenylphenyl)-N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]propanamide is CC(C(=O)NCCc1c[nH]c2ccc(O)cc12)c1ccc(-c2ccccc2)c(F)c1.
What is the InChIKey of 2-(3-fluoro-4-phenylphenyl)-N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]propanamide?
The InChIKey is RWRSAYHAZBVTII-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23FN2O2/c1-16(18-7-9-21(23(26)13-18)17-5-3-2-4-6-17)25(30)27-12-11-19-15-28-24-10-8-20(29)14-22(19)24/h2-10,13-16,28-29H,11-12H2,1H3,(H,27,30).
What are the key properties of 2-(3-fluoro-4-phenylphenyl)-N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]propanamide?
2-(3-fluoro-4-phenylphenyl)-N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]propanamide has a molecular weight of 402.47 g/mol, XLogP of 5.14, 6 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluoro-4-phenylphenyl)-N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]propanamide is sourced from PubChem (CID 118723549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).