4-(4-ethoxyphenyl)-1H-indole

C16H15NO — CID 141124806

IUPAC4-(4-ethoxyphenyl)-1H-indole
SMILESCCOc1ccc(-c2cccc3[nH]ccc23)cc1
InChIInChI=1S/C16H15NO/c1-2-18-13-8-6-12(7-9-13)14-4-3-5-16-15(14)10-11-17-16/h3-11,17H,2H2,1H3
InChIKeyHOLZTQLLCPWNDO-UHFFFAOYSA-N
MW237.30 g/mol
LogP4.23
Rot. Bonds3

About 4-(4-ethoxyphenyl)-1H-indole

4-(4-ethoxyphenyl)-1H-indole (PubChem CID 141124806) has the molecular formula C16H15NO and a molecular weight of 237.30 g/mol. Its IUPAC name is 4-(4-ethoxyphenyl)-1H-indole.

Molecular Properties

Compound Name4-(4-ethoxyphenyl)-1H-indole
PubChem CID141124806
Molecular FormulaC16H15NO
Molecular Weight237.30 g/mol
Exact Mass237.12
IUPAC Name4-(4-ethoxyphenyl)-1H-indole
SMILESCCOc1ccc(-c2cccc3[nH]ccc23)cc1
InChIInChI=1S/C16H15NO/c1-2-18-13-8-6-12(7-9-13)14-4-3-5-16-15(14)10-11-17-16/h3-11,17H,2H2,1H3
InChIKeyHOLZTQLLCPWNDO-UHFFFAOYSA-N
XLogP4.23
TPSA25.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-[[2-(4-ethoxyphenyl)imidazol-1-yl]methyl]-1H-indole
CID 56863418
4-(4-ethoxyphenyl)-1H-indole-2-carboxylic acid
CID 66841435
4-(4-methylsulfonylphenyl)-1H-indole
CID 50973001
1,2,4,5-tetrakis[2-(4-ethoxyphenyl)phenyl]benzene
CID 59789051
N-[3-(6-ethoxy-3-pyridinyl)-5-(1H-indol-4-yl)phenyl]acetamide
CID 25115108
2-ethoxy-1,3,4-tris(4-ethoxyphenyl)benzene
CID 173362856
5-(1H-indol-4-yl)-1H-pyridin-2-one
CID 122200265
N-[(4-ethoxyphenyl)methyl]-3-(1H-indol-4-yl)propanamide
CID 53160301
ethyl 4-cyano-3-[4-(1H-indol-4-yl)phenyl]-1-methylpyrrole-2-carboxylate
CID 69023196
2-ethoxy-1,3-diphenylbenzene;zinc
CID 175181234
ethane;4-(3-propan-2-ylphenyl)-1H-indole
CID 156726959
2-(4-ethoxyphenyl)-N,N-diethylaniline
CID 70567665

Frequently Asked Questions

What is the IUPAC name of 4-(4-ethoxyphenyl)-1H-indole?
The IUPAC name of 4-(4-ethoxyphenyl)-1H-indole (CID 141124806) is 4-(4-ethoxyphenyl)-1H-indole.
What is the SMILES notation for 4-(4-ethoxyphenyl)-1H-indole?
The canonical SMILES for 4-(4-ethoxyphenyl)-1H-indole is CCOc1ccc(-c2cccc3[nH]ccc23)cc1.
What is the InChIKey of 4-(4-ethoxyphenyl)-1H-indole?
The InChIKey is HOLZTQLLCPWNDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO/c1-2-18-13-8-6-12(7-9-13)14-4-3-5-16-15(14)10-11-17-16/h3-11,17H,2H2,1H3.
What are the key properties of 4-(4-ethoxyphenyl)-1H-indole?
4-(4-ethoxyphenyl)-1H-indole has a molecular weight of 237.30 g/mol, XLogP of 4.23, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-ethoxyphenyl)-1H-indole is sourced from PubChem (CID 141124806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).