[3-phenyl-5-(trifluoromethyl)-2-pyridinyl]methanol

C13H10F3NO — CID 118812916

IUPAC[3-phenyl-5-(trifluoromethyl)-2-pyridinyl]methanol
SMILESOCc1ncc(C(F)(F)F)cc1-c1ccccc1
InChIInChI=1S/C13H10F3NO/c14-13(15,16)10-6-11(12(8-18)17-7-10)9-4-2-1-3-5-9/h1-7,18H,8H2
InChIKeyNIQSUJULFQVVNS-UHFFFAOYSA-N
MW253.22 g/mol
LogP3.26
Rot. Bonds2

About [3-phenyl-5-(trifluoromethyl)-2-pyridinyl]methanol

[3-phenyl-5-(trifluoromethyl)-2-pyridinyl]methanol (PubChem CID 118812916) has the molecular formula C13H10F3NO and a molecular weight of 253.22 g/mol. Its IUPAC name is [3-phenyl-5-(trifluoromethyl)-2-pyridinyl]methanol.

Molecular Properties

Compound Name[3-phenyl-5-(trifluoromethyl)-2-pyridinyl]methanol
PubChem CID118812916
Molecular FormulaC13H10F3NO
Molecular Weight253.22 g/mol
Exact Mass253.07
IUPAC Name[3-phenyl-5-(trifluoromethyl)-2-pyridinyl]methanol
SMILESOCc1ncc(C(F)(F)F)cc1-c1ccccc1
InChIInChI=1S/C13H10F3NO/c14-13(15,16)10-6-11(12(8-18)17-7-10)9-4-2-1-3-5-9/h1-7,18H,8H2
InChIKeyNIQSUJULFQVVNS-UHFFFAOYSA-N
XLogP3.26
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.22
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[3-(2-fluorophenyl)-5-(trifluoromethyl)-2-pyridinyl]methanol
CID 131870563
2-[3-pyridin-3-yl-5-(trifluoromethyl)-2-pyridinyl]acetonitrile
CID 131870344
[3-[3-(trifluoromethyl)phenyl]-2-pyridinyl]methanol
CID 134621668
2-(hydroxymethyl)-5-[4-(trifluoromethyl)phenyl]pyridin-3-ol
CID 133091895
2-[3-[2-(trifluoromethoxy)phenyl]-5-(trifluoromethyl)-2-pyridinyl]acetic acid
CID 134621231
2-[5-(trifluoromethyl)-3-[2-(trifluoromethyl)phenyl]-2-pyridinyl]acetonitrile
CID 134628875
2-methoxy-1,3-diphenyl-5-(trifluoromethyl)benzene
CID 146622594
2-[5-chloro-3-[4-(trifluoromethyl)phenyl]-2-pyridinyl]acetic acid
CID 134629724
[5-(3-fluorophenyl)-3-(trifluoromethyl)-2-pyridinyl]methanol
CID 131870235
3-chloro-2-[2-(2-chlorophenyl)ethyl]-5-(trifluoromethyl)pyridine
CID 134966661
1-fluoro-2-phenyl-4-(trifluoromethyl)benzene
CID 46314964
5-tert-butyl-2-fluoro-3-phenylpyridine
CID 165372109

Frequently Asked Questions

What is the IUPAC name of [3-phenyl-5-(trifluoromethyl)-2-pyridinyl]methanol?
The IUPAC name of [3-phenyl-5-(trifluoromethyl)-2-pyridinyl]methanol (CID 118812916) is [3-phenyl-5-(trifluoromethyl)-2-pyridinyl]methanol.
What is the SMILES notation for [3-phenyl-5-(trifluoromethyl)-2-pyridinyl]methanol?
The canonical SMILES for [3-phenyl-5-(trifluoromethyl)-2-pyridinyl]methanol is OCc1ncc(C(F)(F)F)cc1-c1ccccc1.
What is the InChIKey of [3-phenyl-5-(trifluoromethyl)-2-pyridinyl]methanol?
The InChIKey is NIQSUJULFQVVNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10F3NO/c14-13(15,16)10-6-11(12(8-18)17-7-10)9-4-2-1-3-5-9/h1-7,18H,8H2.
What are the key properties of [3-phenyl-5-(trifluoromethyl)-2-pyridinyl]methanol?
[3-phenyl-5-(trifluoromethyl)-2-pyridinyl]methanol has a molecular weight of 253.22 g/mol, XLogP of 3.26, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-phenyl-5-(trifluoromethyl)-2-pyridinyl]methanol is sourced from PubChem (CID 118812916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).