2-(2,5-diphenylpyrrol-1-yl)ethanol

C18H17NO — CID 125482287

IUPAC2-(2,5-diphenylpyrrol-1-yl)ethanol
SMILESOCCn1c(-c2ccccc2)ccc1-c1ccccc1
InChIInChI=1S/C18H17NO/c20-14-13-19-17(15-7-3-1-4-8-15)11-12-18(19)16-9-5-2-6-10-16/h1-12,20H,13-14H2
InChIKeyOHSYIGMYOACWET-UHFFFAOYSA-N
MW263.34 g/mol
LogP3.81
Rot. Bonds4

About 2-(2,5-diphenylpyrrol-1-yl)ethanol

2-(2,5-diphenylpyrrol-1-yl)ethanol (PubChem CID 125482287) has the molecular formula C18H17NO and a molecular weight of 263.34 g/mol. Its IUPAC name is 2-(2,5-diphenylpyrrol-1-yl)ethanol.

Molecular Properties

Compound Name2-(2,5-diphenylpyrrol-1-yl)ethanol
PubChem CID125482287
Molecular FormulaC18H17NO
Molecular Weight263.34 g/mol
Exact Mass263.13
IUPAC Name2-(2,5-diphenylpyrrol-1-yl)ethanol
SMILESOCCn1c(-c2ccccc2)ccc1-c1ccccc1
InChIInChI=1S/C18H17NO/c20-14-13-19-17(15-7-3-1-4-8-15)11-12-18(19)16-9-5-2-6-10-16/h1-12,20H,13-14H2
InChIKeyOHSYIGMYOACWET-UHFFFAOYSA-N
XLogP3.81
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,5-diphenylpyrrol-1-yl)ethanol?
The IUPAC name of 2-(2,5-diphenylpyrrol-1-yl)ethanol (CID 125482287) is 2-(2,5-diphenylpyrrol-1-yl)ethanol.
What is the SMILES notation for 2-(2,5-diphenylpyrrol-1-yl)ethanol?
The canonical SMILES for 2-(2,5-diphenylpyrrol-1-yl)ethanol is OCCn1c(-c2ccccc2)ccc1-c1ccccc1.
What is the InChIKey of 2-(2,5-diphenylpyrrol-1-yl)ethanol?
The InChIKey is OHSYIGMYOACWET-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17NO/c20-14-13-19-17(15-7-3-1-4-8-15)11-12-18(19)16-9-5-2-6-10-16/h1-12,20H,13-14H2.
What are the key properties of 2-(2,5-diphenylpyrrol-1-yl)ethanol?
2-(2,5-diphenylpyrrol-1-yl)ethanol has a molecular weight of 263.34 g/mol, XLogP of 3.81, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-diphenylpyrrol-1-yl)ethanol is sourced from PubChem (CID 125482287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).