[4-ethyl-6-methoxy-2-(4-methoxyphenyl)-1H-indol-3-yl]-(4-hydroxyphenyl)methanone

C25H23NO4 — CID 67633746

IUPAC[4-ethyl-6-methoxy-2-(4-methoxyphenyl)-1H-indol-3-yl]-(4-hydroxyphenyl)methanone
SMILESCCc1cc(OC)cc2[nH]c(-c3ccc(OC)cc3)c(C(=O)c3ccc(O)cc3)c12
InChIInChI=1S/C25H23NO4/c1-4-15-13-20(30-3)14-21-22(15)23(25(28)17-5-9-18(27)10-6-17)24(26-21)16-7-11-19(29-2)12-8-16/h5-14,26-27H,4H2,1-3H3
InChIKeyOCXJLGCOHFYDBA-UHFFFAOYSA-N
MW401.46 g/mol
LogP5.35
Rot. Bonds6

About [4-ethyl-6-methoxy-2-(4-methoxyphenyl)-1H-indol-3-yl]-(4-hydroxyphenyl)methanone

[4-ethyl-6-methoxy-2-(4-methoxyphenyl)-1H-indol-3-yl]-(4-hydroxyphenyl)methanone (PubChem CID 67633746) has the molecular formula C25H23NO4 and a molecular weight of 401.46 g/mol. Its IUPAC name is [4-ethyl-6-methoxy-2-(4-methoxyphenyl)-1H-indol-3-yl]-(4-hydroxyphenyl)methanone.

Molecular Properties

Compound Name[4-ethyl-6-methoxy-2-(4-methoxyphenyl)-1H-indol-3-yl]-(4-hydroxyphenyl)methanone
PubChem CID67633746
Molecular FormulaC25H23NO4
Molecular Weight401.46 g/mol
Exact Mass401.16
IUPAC Name[4-ethyl-6-methoxy-2-(4-methoxyphenyl)-1H-indol-3-yl]-(4-hydroxyphenyl)methanone
SMILESCCc1cc(OC)cc2[nH]c(-c3ccc(OC)cc3)c(C(=O)c3ccc(O)cc3)c12
InChIInChI=1S/C25H23NO4/c1-4-15-13-20(30-3)14-21-22(15)23(25(28)17-5-9-18(27)10-6-17)24(26-21)16-7-11-19(29-2)12-8-16/h5-14,26-27H,4H2,1-3H3
InChIKeyOCXJLGCOHFYDBA-UHFFFAOYSA-N
XLogP5.35
TPSA71.55 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500401.46
LogP ≤ 55.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze [4-ethyl-6-methoxy-2-(4-methoxyphenyl)-1H-indol-3-yl]-(4-hydroxyphenyl)methanone with MolForge

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Related Compounds

4-(3-cyano-4-ethyl-6-methoxy-1H-indol-2-yl)benzoic acid
CID 69183708
[2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]-(4-methoxyphenyl)methanone
CID 18318529
(4-hydroxyphenyl)-[4-[4-[4-[4-(4-methoxybenzoyl)benzoyl]phenoxy]benzoyl]phenyl]methanone
CID 140957067
4-[4,5-bis(4-methoxyphenyl)-1H-imidazol-2-yl]phenol
CID 1101726
ethyl 4-(3,5,7-trimethoxy-4-oxo-1H-quinolin-2-yl)benzoate
CID 10833824
4-[4,5-bis(4-methoxyphenyl)-1H-imidazol-2-yl]phenol;ethane
CID 142013542
(4-methoxyphenyl)methyl 4-(4-hydroxyphenyl)benzoate
CID 16577371
(4-hydroxyphenyl)-[4-[4-[4-(N-(4-methoxyphenyl)-4-phenylanilino)phenyl]phenoxy]phenyl]methanone
CID 71009635
[4-[2-(4-methoxyphenyl)-4-phenyl-1H-imidazol-5-yl]phenyl]-[4-[2-(4-methoxyphenyl)-5-phenyl-1H-imidazol-4-yl]phenyl]methanone
CID 135495721
2-(4-methoxyphenyl)-3-methyl-1H-indol-5-ol
CID 142624936
[2-(4-hydroxyphenyl)-1-benzofuran-3-yl]-(4-methoxyphenyl)methanone
CID 54105837
5-ethyl-6-(4-methoxyphenyl)-2-oxo-1H-pyridine-3-carboxylic acid
CID 71281958

Frequently Asked Questions

What is the IUPAC name of [4-ethyl-6-methoxy-2-(4-methoxyphenyl)-1H-indol-3-yl]-(4-hydroxyphenyl)methanone?
The IUPAC name of [4-ethyl-6-methoxy-2-(4-methoxyphenyl)-1H-indol-3-yl]-(4-hydroxyphenyl)methanone (CID 67633746) is [4-ethyl-6-methoxy-2-(4-methoxyphenyl)-1H-indol-3-yl]-(4-hydroxyphenyl)methanone.
What is the SMILES notation for [4-ethyl-6-methoxy-2-(4-methoxyphenyl)-1H-indol-3-yl]-(4-hydroxyphenyl)methanone?
The canonical SMILES for [4-ethyl-6-methoxy-2-(4-methoxyphenyl)-1H-indol-3-yl]-(4-hydroxyphenyl)methanone is CCc1cc(OC)cc2[nH]c(-c3ccc(OC)cc3)c(C(=O)c3ccc(O)cc3)c12.
What is the InChIKey of [4-ethyl-6-methoxy-2-(4-methoxyphenyl)-1H-indol-3-yl]-(4-hydroxyphenyl)methanone?
The InChIKey is OCXJLGCOHFYDBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23NO4/c1-4-15-13-20(30-3)14-21-22(15)23(25(28)17-5-9-18(27)10-6-17)24(26-21)16-7-11-19(29-2)12-8-16/h5-14,26-27H,4H2,1-3H3.
What are the key properties of [4-ethyl-6-methoxy-2-(4-methoxyphenyl)-1H-indol-3-yl]-(4-hydroxyphenyl)methanone?
[4-ethyl-6-methoxy-2-(4-methoxyphenyl)-1H-indol-3-yl]-(4-hydroxyphenyl)methanone has a molecular weight of 401.46 g/mol, XLogP of 5.35, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-ethyl-6-methoxy-2-(4-methoxyphenyl)-1H-indol-3-yl]-(4-hydroxyphenyl)methanone is sourced from PubChem (CID 67633746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).