[2-(4-fluorophenyl)-4-phenyl-6-propan-2-ylphenyl]methanol

C22H21FO — CID 15015056

IUPAC[2-(4-fluorophenyl)-4-phenyl-6-propan-2-ylphenyl]methanol
SMILESCC(C)c1cc(-c2ccccc2)cc(-c2ccc(F)cc2)c1CO
InChIInChI=1S/C22H21FO/c1-15(2)20-12-18(16-6-4-3-5-7-16)13-21(22(20)14-24)17-8-10-19(23)11-9-17/h3-13,15,24H,14H2,1-2H3
InChIKeyMMRVWYQQTLQSPD-UHFFFAOYSA-N
MW320.41 g/mol
LogP5.78
Rot. Bonds4

About [2-(4-fluorophenyl)-4-phenyl-6-propan-2-ylphenyl]methanol

[2-(4-fluorophenyl)-4-phenyl-6-propan-2-ylphenyl]methanol (PubChem CID 15015056) has the molecular formula C22H21FO and a molecular weight of 320.41 g/mol. Its IUPAC name is [2-(4-fluorophenyl)-4-phenyl-6-propan-2-ylphenyl]methanol.

Molecular Properties

Compound Name[2-(4-fluorophenyl)-4-phenyl-6-propan-2-ylphenyl]methanol
PubChem CID15015056
Molecular FormulaC22H21FO
Molecular Weight320.41 g/mol
Exact Mass320.16
IUPAC Name[2-(4-fluorophenyl)-4-phenyl-6-propan-2-ylphenyl]methanol
SMILESCC(C)c1cc(-c2ccccc2)cc(-c2ccc(F)cc2)c1CO
InChIInChI=1S/C22H21FO/c1-15(2)20-12-18(16-6-4-3-5-7-16)13-21(22(20)14-24)17-8-10-19(23)11-9-17/h3-13,15,24H,14H2,1-2H3
InChIKeyMMRVWYQQTLQSPD-UHFFFAOYSA-N
XLogP5.78
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500320.41
LogP ≤ 55.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of [2-(4-fluorophenyl)-4-phenyl-6-propan-2-ylphenyl]methanol?
The IUPAC name of [2-(4-fluorophenyl)-4-phenyl-6-propan-2-ylphenyl]methanol (CID 15015056) is [2-(4-fluorophenyl)-4-phenyl-6-propan-2-ylphenyl]methanol.
What is the SMILES notation for [2-(4-fluorophenyl)-4-phenyl-6-propan-2-ylphenyl]methanol?
The canonical SMILES for [2-(4-fluorophenyl)-4-phenyl-6-propan-2-ylphenyl]methanol is CC(C)c1cc(-c2ccccc2)cc(-c2ccc(F)cc2)c1CO.
What is the InChIKey of [2-(4-fluorophenyl)-4-phenyl-6-propan-2-ylphenyl]methanol?
The InChIKey is MMRVWYQQTLQSPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21FO/c1-15(2)20-12-18(16-6-4-3-5-7-16)13-21(22(20)14-24)17-8-10-19(23)11-9-17/h3-13,15,24H,14H2,1-2H3.
What are the key properties of [2-(4-fluorophenyl)-4-phenyl-6-propan-2-ylphenyl]methanol?
[2-(4-fluorophenyl)-4-phenyl-6-propan-2-ylphenyl]methanol has a molecular weight of 320.41 g/mol, XLogP of 5.78, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-fluorophenyl)-4-phenyl-6-propan-2-ylphenyl]methanol is sourced from PubChem (CID 15015056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).