N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-2-(2-phenylindol-1-yl)acetamide

C25H24N2O3 — CID 47029046

IUPACN-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-2-(2-phenylindol-1-yl)acetamide
SMILESCOc1ccc(C(O)CNC(=O)Cn2c(-c3ccccc3)cc3ccccc32)cc1
InChIInChI=1S/C25H24N2O3/c1-30-21-13-11-19(12-14-21)24(28)16-26-25(29)17-27-22-10-6-5-9-20(22)15-23(27)18-7-3-2-4-8-18/h2-15,24,28H,16-17H2,1H3,(H,26,29)
InChIKeyHBMFFEDCDMKNQY-UHFFFAOYSA-N
MW400.48 g/mol
LogP4.17
Rot. Bonds7

About N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-2-(2-phenylindol-1-yl)acetamide

N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-2-(2-phenylindol-1-yl)acetamide (PubChem CID 47029046) has the molecular formula C25H24N2O3 and a molecular weight of 400.48 g/mol. Its IUPAC name is N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-2-(2-phenylindol-1-yl)acetamide.

Molecular Properties

Compound NameN-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-2-(2-phenylindol-1-yl)acetamide
PubChem CID47029046
Molecular FormulaC25H24N2O3
Molecular Weight400.48 g/mol
Exact Mass400.18
IUPAC NameN-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-2-(2-phenylindol-1-yl)acetamide
SMILESCOc1ccc(C(O)CNC(=O)Cn2c(-c3ccccc3)cc3ccccc32)cc1
InChIInChI=1S/C25H24N2O3/c1-30-21-13-11-19(12-14-21)24(28)16-26-25(29)17-27-22-10-6-5-9-20(22)15-23(27)18-7-3-2-4-8-18/h2-15,24,28H,16-17H2,1H3,(H,26,29)
InChIKeyHBMFFEDCDMKNQY-UHFFFAOYSA-N
XLogP4.17
TPSA63.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.48
LogP ≤ 54.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-ethyl-N-[(2S)-2-hydroxy-2-(4-methoxyphenyl)ethyl]indole-2-carboxamide
CID 52522890
N-[(2S)-2-hydroxy-2-naphthalen-2-ylethyl]-2-(4-methoxyphenyl)acetamide
CID 95618415
N-(2-hydroxy-2-naphthalen-2-ylethyl)-2-(4-methoxyphenyl)acetamide
CID 56785818
2-(3,4-difluorophenyl)-N-methyl-2-[[2-(2-phenylindol-1-yl)acetyl]amino]acetamide
CID 55483076
2-(2-phenylindol-1-yl)-N-[1-(4-phenylphenyl)propan-2-yl]acetamide
CID 155968281
2-[benzyl(methyl)amino]-N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]acetamide
CID 110908744
N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-3-(5-phenylfuran-2-yl)propanamide
CID 42959591
N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-4-methyl-4-phenylpentanamide
CID 109380164
N-[2-(4-methoxyphenyl)ethyl]-2-(2-methylindol-1-yl)acetamide
CID 26586028
N,N,2-trimethyl-2-[[2-(2-phenylindol-1-yl)acetyl]amino]propanamide
CID 86899973
[2-hydroxy-2-(4-methoxyphenyl)ethyl]urea
CID 137321016
N-[[1-(difluoromethyl)imidazol-2-yl]methyl]-2-(2-phenylindol-1-yl)acetamide
CID 86860184

Frequently Asked Questions

What is the IUPAC name of N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-2-(2-phenylindol-1-yl)acetamide?
The IUPAC name of N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-2-(2-phenylindol-1-yl)acetamide (CID 47029046) is N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-2-(2-phenylindol-1-yl)acetamide.
What is the SMILES notation for N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-2-(2-phenylindol-1-yl)acetamide?
The canonical SMILES for N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-2-(2-phenylindol-1-yl)acetamide is COc1ccc(C(O)CNC(=O)Cn2c(-c3ccccc3)cc3ccccc32)cc1.
What is the InChIKey of N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-2-(2-phenylindol-1-yl)acetamide?
The InChIKey is HBMFFEDCDMKNQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N2O3/c1-30-21-13-11-19(12-14-21)24(28)16-26-25(29)17-27-22-10-6-5-9-20(22)15-23(27)18-7-3-2-4-8-18/h2-15,24,28H,16-17H2,1H3,(H,26,29).
What are the key properties of N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-2-(2-phenylindol-1-yl)acetamide?
N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-2-(2-phenylindol-1-yl)acetamide has a molecular weight of 400.48 g/mol, XLogP of 4.17, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-2-(2-phenylindol-1-yl)acetamide is sourced from PubChem (CID 47029046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).