(4-methylphenyl)-pyridin-4-yl-[4-(trifluoromethyl)phenyl]methanol

C20H16F3NO — CID 23592238

IUPAC(4-methylphenyl)-pyridin-4-yl-[4-(trifluoromethyl)phenyl]methanol
SMILESCc1ccc(C(O)(c2ccncc2)c2ccc(C(F)(F)F)cc2)cc1
InChIInChI=1S/C20H16F3NO/c1-14-2-4-15(5-3-14)19(25,17-10-12-24-13-11-17)16-6-8-18(9-7-16)20(21,22)23/h2-13,25H,1H3
InChIKeyBOZXLOVSIRZABX-UHFFFAOYSA-N
MW343.35 g/mol
LogP4.69
Rot. Bonds3

About (4-methylphenyl)-pyridin-4-yl-[4-(trifluoromethyl)phenyl]methanol

(4-methylphenyl)-pyridin-4-yl-[4-(trifluoromethyl)phenyl]methanol (PubChem CID 23592238) has the molecular formula C20H16F3NO and a molecular weight of 343.35 g/mol. Its IUPAC name is (4-methylphenyl)-pyridin-4-yl-[4-(trifluoromethyl)phenyl]methanol.

Molecular Properties

Compound Name(4-methylphenyl)-pyridin-4-yl-[4-(trifluoromethyl)phenyl]methanol
PubChem CID23592238
Molecular FormulaC20H16F3NO
Molecular Weight343.35 g/mol
Exact Mass343.12
IUPAC Name(4-methylphenyl)-pyridin-4-yl-[4-(trifluoromethyl)phenyl]methanol
SMILESCc1ccc(C(O)(c2ccncc2)c2ccc(C(F)(F)F)cc2)cc1
InChIInChI=1S/C20H16F3NO/c1-14-2-4-15(5-3-14)19(25,17-10-12-24-13-11-17)16-6-8-18(9-7-16)20(21,22)23/h2-13,25H,1H3
InChIKeyBOZXLOVSIRZABX-UHFFFAOYSA-N
XLogP4.69
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.35
LogP ≤ 54.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 51035449
Pirmenol
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alpha-Phenyl-4-pyridinemethanol
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alpha,alpha-Diphenyl-4-pyridinemethanol
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Alpha,alpha-diphenyl-2-pyridinemethanol
CID 223294
5-(1,1-Dimethyl-heptyl)-2-pyridin-3-yl-phenol
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6-(3,4-Difluorophenyl)-1-(pyridin-4-yl)-1,2,3,4-tetrahydronaphthalen-1-ol
CID 25033652
6-(4-Fluorophenyl)-1-(pyridin-4-yl)-1,2,3,4-tetrahydronaphthalen-1-ol
CID 25033730
5-(4-Fluorophenyl)-1-(pyridin-4-yl)-2,3-dihydro-1H-inden-1-ol
CID 25034657
4''-(1-(Pyridin-4-yl)propyl)biphenyl-3-ol
CID 46854448
4''-(2-Methyl-1-(pyridin-4-yl)propyl)biphenyl-3-ol
CID 46854449
3-Fluoro-4''-(1-(pyridin-4-yl)propyl)biphenyl-4-ol
CID 46854606

Frequently Asked Questions

What is the IUPAC name of (4-methylphenyl)-pyridin-4-yl-[4-(trifluoromethyl)phenyl]methanol?
The IUPAC name of (4-methylphenyl)-pyridin-4-yl-[4-(trifluoromethyl)phenyl]methanol (CID 23592238) is (4-methylphenyl)-pyridin-4-yl-[4-(trifluoromethyl)phenyl]methanol.
What is the SMILES notation for (4-methylphenyl)-pyridin-4-yl-[4-(trifluoromethyl)phenyl]methanol?
The canonical SMILES for (4-methylphenyl)-pyridin-4-yl-[4-(trifluoromethyl)phenyl]methanol is Cc1ccc(C(O)(c2ccncc2)c2ccc(C(F)(F)F)cc2)cc1.
What is the InChIKey of (4-methylphenyl)-pyridin-4-yl-[4-(trifluoromethyl)phenyl]methanol?
The InChIKey is BOZXLOVSIRZABX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16F3NO/c1-14-2-4-15(5-3-14)19(25,17-10-12-24-13-11-17)16-6-8-18(9-7-16)20(21,22)23/h2-13,25H,1H3.
What are the key properties of (4-methylphenyl)-pyridin-4-yl-[4-(trifluoromethyl)phenyl]methanol?
(4-methylphenyl)-pyridin-4-yl-[4-(trifluoromethyl)phenyl]methanol has a molecular weight of 343.35 g/mol, XLogP of 4.69, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylphenyl)-pyridin-4-yl-[4-(trifluoromethyl)phenyl]methanol is sourced from PubChem (CID 23592238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).