trimethyl-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-3-pyridinyl]germane

C20H21GeN — CID 156660153

IUPACtrimethyl-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-3-pyridinyl]germane
SMILES[2H]c1c([2H])c([2H])c(-c2cc(-c3ccccc3)ncc2[Ge](C)(C)C)c([2H])c1[2H]
InChIInChI=1S/C20H21GeN/c1-21(2,3)19-15-22-20(17-12-8-5-9-13-17)14-18(19)16-10-6-4-7-11-16/h4-15H,1-3H3/i4D,6D,7D,10D,11D
InChIKeyKOEYRKBPTOPWFN-BGCGZSDZSA-N
MW353.04 g/mol
LogP4.96
Rot. Bonds3

About trimethyl-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-3-pyridinyl]germane

trimethyl-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-3-pyridinyl]germane (PubChem CID 156660153) has the molecular formula C20H21GeN and a molecular weight of 353.04 g/mol. Its IUPAC name is trimethyl-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-3-pyridinyl]germane.

Molecular Properties

Compound Nametrimethyl-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-3-pyridinyl]germane
PubChem CID156660153
Molecular FormulaC20H21GeN
Molecular Weight353.04 g/mol
Exact Mass354.12
IUPAC Nametrimethyl-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-3-pyridinyl]germane
SMILES[2H]c1c([2H])c([2H])c(-c2cc(-c3ccccc3)ncc2[Ge](C)(C)C)c([2H])c1[2H]
InChIInChI=1S/C20H21GeN/c1-21(2,3)19-15-22-20(17-12-8-5-9-13-17)14-18(19)16-10-6-4-7-11-16/h4-15H,1-3H3/i4D,6D,7D,10D,11D
InChIKeyKOEYRKBPTOPWFN-BGCGZSDZSA-N
XLogP4.96
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.04
LogP ≤ 54.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of trimethyl-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-3-pyridinyl]germane?
The IUPAC name of trimethyl-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-3-pyridinyl]germane (CID 156660153) is trimethyl-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-3-pyridinyl]germane.
What is the SMILES notation for trimethyl-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-3-pyridinyl]germane?
The canonical SMILES for trimethyl-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-3-pyridinyl]germane is [2H]c1c([2H])c([2H])c(-c2cc(-c3ccccc3)ncc2[Ge](C)(C)C)c([2H])c1[2H].
What is the InChIKey of trimethyl-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-3-pyridinyl]germane?
The InChIKey is KOEYRKBPTOPWFN-BGCGZSDZSA-N. The full InChI is InChI=1S/C20H21GeN/c1-21(2,3)19-15-22-20(17-12-8-5-9-13-17)14-18(19)16-10-6-4-7-11-16/h4-15H,1-3H3/i4D,6D,7D,10D,11D.
What are the key properties of trimethyl-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-3-pyridinyl]germane?
trimethyl-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-3-pyridinyl]germane has a molecular weight of 353.04 g/mol, XLogP of 4.96, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-3-pyridinyl]germane is sourced from PubChem (CID 156660153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).