[4-(4-fluorophenyl)-1-phenyl-2-propan-2-ylpyrrol-3-yl]methanol

C20H20FNO — CID 19993794

IUPAC[4-(4-fluorophenyl)-1-phenyl-2-propan-2-ylpyrrol-3-yl]methanol
SMILESCC(C)c1c(CO)c(-c2ccc(F)cc2)cn1-c1ccccc1
InChIInChI=1S/C20H20FNO/c1-14(2)20-19(13-23)18(15-8-10-16(21)11-9-15)12-22(20)17-6-4-3-5-7-17/h3-12,14,23H,13H2,1-2H3
InChIKeyZFENGPYDDGRKNE-UHFFFAOYSA-N
MW309.38 g/mol
LogP4.90
Rot. Bonds4

About [4-(4-fluorophenyl)-1-phenyl-2-propan-2-ylpyrrol-3-yl]methanol

[4-(4-fluorophenyl)-1-phenyl-2-propan-2-ylpyrrol-3-yl]methanol (PubChem CID 19993794) has the molecular formula C20H20FNO and a molecular weight of 309.38 g/mol. Its IUPAC name is [4-(4-fluorophenyl)-1-phenyl-2-propan-2-ylpyrrol-3-yl]methanol.

Molecular Properties

Compound Name[4-(4-fluorophenyl)-1-phenyl-2-propan-2-ylpyrrol-3-yl]methanol
PubChem CID19993794
Molecular FormulaC20H20FNO
Molecular Weight309.38 g/mol
Exact Mass309.15
IUPAC Name[4-(4-fluorophenyl)-1-phenyl-2-propan-2-ylpyrrol-3-yl]methanol
SMILESCC(C)c1c(CO)c(-c2ccc(F)cc2)cn1-c1ccccc1
InChIInChI=1S/C20H20FNO/c1-14(2)20-19(13-23)18(15-8-10-16(21)11-9-15)12-22(20)17-6-4-3-5-7-17/h3-12,14,23H,13H2,1-2H3
InChIKeyZFENGPYDDGRKNE-UHFFFAOYSA-N
XLogP4.90
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.38
LogP ≤ 54.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[4-(1H-Pyrrol-1-yl)phenyl]methanol
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N-methoxyindole-3-carbinol
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alpha,alpha-Diphenyl-2-pyridineethanol
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1-(1-methyl-1H-indol-3-yl)-2-(1-piperidinyl)ethanol
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(1-Benzyl-1h-indol-3-yl)methanol
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[1-(4-methylbenzyl)-1H-indol-3-yl]methanol
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2-(1H-indol-1-yl)-1-phenylethanol
CID 11842267
[1-[[3-(Trifluoromethyl)phenyl]methyl]indol-3-yl]methanol
CID 16738801
[1-[(4-Chlorophenyl)methyl]-5-fluoroindol-3-yl]methanol
CID 52951097
[1-Benzyl-2,5-dimethyl-4-(4-nitrophenyl)pyrrol-3-yl]methanol
CID 57403125
[1-[1-(4-Propan-2-ylcyclohexyl)piperidin-4-yl]indol-3-yl]methanol
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2-Hydroxy-2,3-diphenyl-2,3-dihydro-1H-indolizinylium
CID 16236812

Frequently Asked Questions

What is the IUPAC name of [4-(4-fluorophenyl)-1-phenyl-2-propan-2-ylpyrrol-3-yl]methanol?
The IUPAC name of [4-(4-fluorophenyl)-1-phenyl-2-propan-2-ylpyrrol-3-yl]methanol (CID 19993794) is [4-(4-fluorophenyl)-1-phenyl-2-propan-2-ylpyrrol-3-yl]methanol.
What is the SMILES notation for [4-(4-fluorophenyl)-1-phenyl-2-propan-2-ylpyrrol-3-yl]methanol?
The canonical SMILES for [4-(4-fluorophenyl)-1-phenyl-2-propan-2-ylpyrrol-3-yl]methanol is CC(C)c1c(CO)c(-c2ccc(F)cc2)cn1-c1ccccc1.
What is the InChIKey of [4-(4-fluorophenyl)-1-phenyl-2-propan-2-ylpyrrol-3-yl]methanol?
The InChIKey is ZFENGPYDDGRKNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20FNO/c1-14(2)20-19(13-23)18(15-8-10-16(21)11-9-15)12-22(20)17-6-4-3-5-7-17/h3-12,14,23H,13H2,1-2H3.
What are the key properties of [4-(4-fluorophenyl)-1-phenyl-2-propan-2-ylpyrrol-3-yl]methanol?
[4-(4-fluorophenyl)-1-phenyl-2-propan-2-ylpyrrol-3-yl]methanol has a molecular weight of 309.38 g/mol, XLogP of 4.90, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-fluorophenyl)-1-phenyl-2-propan-2-ylpyrrol-3-yl]methanol is sourced from PubChem (CID 19993794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).