[4-(4-fluorophenyl)-6-(2-methylphenyl)-2-propan-2-yl-3-pyridinyl]methanol

C22H22FNO — CID 15099525

IUPAC[4-(4-fluorophenyl)-6-(2-methylphenyl)-2-propan-2-yl-3-pyridinyl]methanol
SMILESCc1ccccc1-c1cc(-c2ccc(F)cc2)c(CO)c(C(C)C)n1
InChIInChI=1S/C22H22FNO/c1-14(2)22-20(13-25)19(16-8-10-17(23)11-9-16)12-21(24-22)18-7-5-4-6-15(18)3/h4-12,14,25H,13H2,1-3H3
InChIKeyNQAFONLICVPREU-UHFFFAOYSA-N
MW335.42 g/mol
LogP5.48
Rot. Bonds4

About [4-(4-fluorophenyl)-6-(2-methylphenyl)-2-propan-2-yl-3-pyridinyl]methanol

[4-(4-fluorophenyl)-6-(2-methylphenyl)-2-propan-2-yl-3-pyridinyl]methanol (PubChem CID 15099525) has the molecular formula C22H22FNO and a molecular weight of 335.42 g/mol. Its IUPAC name is [4-(4-fluorophenyl)-6-(2-methylphenyl)-2-propan-2-yl-3-pyridinyl]methanol.

Molecular Properties

Compound Name[4-(4-fluorophenyl)-6-(2-methylphenyl)-2-propan-2-yl-3-pyridinyl]methanol
PubChem CID15099525
Molecular FormulaC22H22FNO
Molecular Weight335.42 g/mol
Exact Mass335.17
IUPAC Name[4-(4-fluorophenyl)-6-(2-methylphenyl)-2-propan-2-yl-3-pyridinyl]methanol
SMILESCc1ccccc1-c1cc(-c2ccc(F)cc2)c(CO)c(C(C)C)n1
InChIInChI=1S/C22H22FNO/c1-14(2)22-20(13-25)19(16-8-10-17(23)11-9-16)12-21(24-22)18-7-5-4-6-15(18)3/h4-12,14,25H,13H2,1-3H3
InChIKeyNQAFONLICVPREU-UHFFFAOYSA-N
XLogP5.48
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500335.42
LogP ≤ 55.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [4-(4-fluorophenyl)-6-(2-methylphenyl)-2-propan-2-yl-3-pyridinyl]methanol?
The IUPAC name of [4-(4-fluorophenyl)-6-(2-methylphenyl)-2-propan-2-yl-3-pyridinyl]methanol (CID 15099525) is [4-(4-fluorophenyl)-6-(2-methylphenyl)-2-propan-2-yl-3-pyridinyl]methanol.
What is the SMILES notation for [4-(4-fluorophenyl)-6-(2-methylphenyl)-2-propan-2-yl-3-pyridinyl]methanol?
The canonical SMILES for [4-(4-fluorophenyl)-6-(2-methylphenyl)-2-propan-2-yl-3-pyridinyl]methanol is Cc1ccccc1-c1cc(-c2ccc(F)cc2)c(CO)c(C(C)C)n1.
What is the InChIKey of [4-(4-fluorophenyl)-6-(2-methylphenyl)-2-propan-2-yl-3-pyridinyl]methanol?
The InChIKey is NQAFONLICVPREU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22FNO/c1-14(2)22-20(13-25)19(16-8-10-17(23)11-9-16)12-21(24-22)18-7-5-4-6-15(18)3/h4-12,14,25H,13H2,1-3H3.
What are the key properties of [4-(4-fluorophenyl)-6-(2-methylphenyl)-2-propan-2-yl-3-pyridinyl]methanol?
[4-(4-fluorophenyl)-6-(2-methylphenyl)-2-propan-2-yl-3-pyridinyl]methanol has a molecular weight of 335.42 g/mol, XLogP of 5.48, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-fluorophenyl)-6-(2-methylphenyl)-2-propan-2-yl-3-pyridinyl]methanol is sourced from PubChem (CID 15099525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).