[2-phenylmethoxy-6-[4-(trifluoromethyl)phenyl]-4-pyridinyl]methanol

C20H16F3NO2 — CID 165437540

IUPAC[2-phenylmethoxy-6-[4-(trifluoromethyl)phenyl]-4-pyridinyl]methanol
SMILESOCc1cc(OCc2ccccc2)nc(-c2ccc(C(F)(F)F)cc2)c1
InChIInChI=1S/C20H16F3NO2/c21-20(22,23)17-8-6-16(7-9-17)18-10-15(12-25)11-19(24-18)26-13-14-4-2-1-3-5-14/h1-11,25H,12-13H2
InChIKeyRJCQWAMVIPDBIP-UHFFFAOYSA-N
MW359.35 g/mol
LogP4.84
Rot. Bonds5

About [2-phenylmethoxy-6-[4-(trifluoromethyl)phenyl]-4-pyridinyl]methanol

[2-phenylmethoxy-6-[4-(trifluoromethyl)phenyl]-4-pyridinyl]methanol (PubChem CID 165437540) has the molecular formula C20H16F3NO2 and a molecular weight of 359.35 g/mol. Its IUPAC name is [2-phenylmethoxy-6-[4-(trifluoromethyl)phenyl]-4-pyridinyl]methanol.

Molecular Properties

Compound Name[2-phenylmethoxy-6-[4-(trifluoromethyl)phenyl]-4-pyridinyl]methanol
PubChem CID165437540
Molecular FormulaC20H16F3NO2
Molecular Weight359.35 g/mol
Exact Mass359.11
IUPAC Name[2-phenylmethoxy-6-[4-(trifluoromethyl)phenyl]-4-pyridinyl]methanol
SMILESOCc1cc(OCc2ccccc2)nc(-c2ccc(C(F)(F)F)cc2)c1
InChIInChI=1S/C20H16F3NO2/c21-20(22,23)17-8-6-16(7-9-17)18-10-15(12-25)11-19(24-18)26-13-14-4-2-1-3-5-14/h1-11,25H,12-13H2
InChIKeyRJCQWAMVIPDBIP-UHFFFAOYSA-N
XLogP4.84
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.35
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(3,4-difluorophenyl)-6-phenylmethoxy-4-pyridinyl]methanol
CID 165437531
3-methyl-6-phenyl-2-phenylmethoxy-4-[4-(trifluoromethyl)phenyl]pyridine
CID 162617775
2-phenylmethoxy-4-[4-(trifluoromethyl)phenyl]pyridine
CID 58901931
[2-ethoxy-6-[4-(trifluoromethyl)phenyl]-4-pyridinyl]methanamine
CID 90390025
2-phenylmethoxy-5-[4-(trifluoromethyl)phenyl]benzoic acid
CID 68869462
2-methylsulfanyl-4-phenylmethoxy-6-[3-(trifluoromethyl)phenyl]pyrimidine
CID 68823165
2-methylsulfonyl-4-phenylmethoxy-6-[3-(trifluoromethyl)phenyl]pyrimidine
CID 68823026
1-phenylmethoxy-4-(trifluoromethyl)benzene;4-(trifluoromethyl)phenol
CID 159669707
1-methyl-4-(3-methyl-4-phenylmethoxyphenyl)-2-[4-(trifluoromethyl)phenyl]imidazole
CID 58510139
N-[(2-phenylmethoxy-4-pyridinyl)methyl]-4-(trifluoromethyl)benzamide
CID 46469686
2-phenylmethoxy-6-[4-(trifluoromethyl)phenyl]benzaldehyde
CID 172993950
[2-fluoro-6-[3-(trifluoromethyl)phenyl]-4-pyridinyl]methanol
CID 133089796

Frequently Asked Questions

What is the IUPAC name of [2-phenylmethoxy-6-[4-(trifluoromethyl)phenyl]-4-pyridinyl]methanol?
The IUPAC name of [2-phenylmethoxy-6-[4-(trifluoromethyl)phenyl]-4-pyridinyl]methanol (CID 165437540) is [2-phenylmethoxy-6-[4-(trifluoromethyl)phenyl]-4-pyridinyl]methanol.
What is the SMILES notation for [2-phenylmethoxy-6-[4-(trifluoromethyl)phenyl]-4-pyridinyl]methanol?
The canonical SMILES for [2-phenylmethoxy-6-[4-(trifluoromethyl)phenyl]-4-pyridinyl]methanol is OCc1cc(OCc2ccccc2)nc(-c2ccc(C(F)(F)F)cc2)c1.
What is the InChIKey of [2-phenylmethoxy-6-[4-(trifluoromethyl)phenyl]-4-pyridinyl]methanol?
The InChIKey is RJCQWAMVIPDBIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16F3NO2/c21-20(22,23)17-8-6-16(7-9-17)18-10-15(12-25)11-19(24-18)26-13-14-4-2-1-3-5-14/h1-11,25H,12-13H2.
What are the key properties of [2-phenylmethoxy-6-[4-(trifluoromethyl)phenyl]-4-pyridinyl]methanol?
[2-phenylmethoxy-6-[4-(trifluoromethyl)phenyl]-4-pyridinyl]methanol has a molecular weight of 359.35 g/mol, XLogP of 4.84, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-phenylmethoxy-6-[4-(trifluoromethyl)phenyl]-4-pyridinyl]methanol is sourced from PubChem (CID 165437540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).