[difluoro-(2-phenyl-4-pyridinyl)methyl]-tris(trifluoromethyl)germane

C15H8F11GeN — CID 169052669

IUPAC[difluoro-(2-phenyl-4-pyridinyl)methyl]-tris(trifluoromethyl)germane
SMILESFC(F)(F)[Ge](C(F)(F)F)(C(F)(F)F)C(F)(F)c1ccnc(-c2ccccc2)c1
InChIInChI=1S/C15H8F11GeN/c16-12(17,27(13(18,19)20,14(21,22)23)15(24,25)26)10-6-7-28-11(8-10)9-4-2-1-3-5-9/h1-8H
InChIKeySHPITYSMDYDPMD-UHFFFAOYSA-N
MW483.82 g/mol
LogP6.13
Rot. Bonds3

About [difluoro-(2-phenyl-4-pyridinyl)methyl]-tris(trifluoromethyl)germane

[difluoro-(2-phenyl-4-pyridinyl)methyl]-tris(trifluoromethyl)germane (PubChem CID 169052669) has the molecular formula C15H8F11GeN and a molecular weight of 483.82 g/mol. Its IUPAC name is [difluoro-(2-phenyl-4-pyridinyl)methyl]-tris(trifluoromethyl)germane.

Molecular Properties

Compound Name[difluoro-(2-phenyl-4-pyridinyl)methyl]-tris(trifluoromethyl)germane
PubChem CID169052669
Molecular FormulaC15H8F11GeN
Molecular Weight483.82 g/mol
Exact Mass484.97
IUPAC Name[difluoro-(2-phenyl-4-pyridinyl)methyl]-tris(trifluoromethyl)germane
SMILESFC(F)(F)[Ge](C(F)(F)F)(C(F)(F)F)C(F)(F)c1ccnc(-c2ccccc2)c1
InChIInChI=1S/C15H8F11GeN/c16-12(17,27(13(18,19)20,14(21,22)23)15(24,25)26)10-6-7-28-11(8-10)9-4-2-1-3-5-9/h1-8H
InChIKeySHPITYSMDYDPMD-UHFFFAOYSA-N
XLogP6.13
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500483.82
LogP ≤ 56.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

[dideuterio-(2-phenyl-4-pyridinyl)methyl]-tris(trifluoromethyl)germane
CID 169052705
4-tert-butyl-2-[3-(4-tert-butyl-2-pyridinyl)phenyl]-6-phenylpyridine
CID 170196288
2-(4-fluorophenyl)-4-(2-phenylpropan-2-yl)pyridine
CID 162708789
tris(4-tert-butyl-2-(3-phenylphenyl)pyridine);iridium(3+)
CID 161156371
2-phenyl-6-pyridin-2-yl-4-(trifluoromethyl)pyridine
CID 135069582
dimethyl-phenyl-(2-phenyl-4-pyridinyl)germane
CID 140726208
silver bis(4-methyl-2-phenylpyridine)
CID 140722040
2-(2-methyl-6-phenylphenyl)-4-(trifluoromethyl)pyridine
CID 138974124
N-(2-hydroxyphenyl)-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide
CID 59673564
[4-[4-(trifluoromethyl)-2-pyridinyl]phenyl]methylidenehydrazine
CID 168531320
2-phenyl-4-[10-(2-phenyl-4-pyridinyl)anthracen-9-yl]pyridine
CID 88908907
2-[4-(chloromethyl)phenyl]-4-(trifluoromethyl)pyridine;hydrochloride
CID 176896090

Frequently Asked Questions

What is the IUPAC name of [difluoro-(2-phenyl-4-pyridinyl)methyl]-tris(trifluoromethyl)germane?
The IUPAC name of [difluoro-(2-phenyl-4-pyridinyl)methyl]-tris(trifluoromethyl)germane (CID 169052669) is [difluoro-(2-phenyl-4-pyridinyl)methyl]-tris(trifluoromethyl)germane.
What is the SMILES notation for [difluoro-(2-phenyl-4-pyridinyl)methyl]-tris(trifluoromethyl)germane?
The canonical SMILES for [difluoro-(2-phenyl-4-pyridinyl)methyl]-tris(trifluoromethyl)germane is FC(F)(F)[Ge](C(F)(F)F)(C(F)(F)F)C(F)(F)c1ccnc(-c2ccccc2)c1.
What is the InChIKey of [difluoro-(2-phenyl-4-pyridinyl)methyl]-tris(trifluoromethyl)germane?
The InChIKey is SHPITYSMDYDPMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H8F11GeN/c16-12(17,27(13(18,19)20,14(21,22)23)15(24,25)26)10-6-7-28-11(8-10)9-4-2-1-3-5-9/h1-8H.
What are the key properties of [difluoro-(2-phenyl-4-pyridinyl)methyl]-tris(trifluoromethyl)germane?
[difluoro-(2-phenyl-4-pyridinyl)methyl]-tris(trifluoromethyl)germane has a molecular weight of 483.82 g/mol, XLogP of 6.13, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [difluoro-(2-phenyl-4-pyridinyl)methyl]-tris(trifluoromethyl)germane is sourced from PubChem (CID 169052669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).