[4-[2-(4-tert-butylnaphthalen-2-yl)-5-methyl-4-pyridinyl]-3-fluorophenyl]-trimethylgermane

C29H32FGeN — CID 171764447

IUPAC[4-[2-(4-tert-butylnaphthalen-2-yl)-5-methyl-4-pyridinyl]-3-fluorophenyl]-trimethylgermane
SMILESCc1cnc(-c2cc(C(C)(C)C)c3ccccc3c2)cc1-c1ccc([Ge](C)(C)C)cc1F
InChIInChI=1S/C29H32FGeN/c1-19-18-32-28(17-25(19)24-13-12-22(16-27(24)30)31(5,6)7)21-14-20-10-8-9-11-23(20)26(15-21)29(2,3)4/h8-18H,1-7H3
InChIKeyLXFLWUZPKSSPIS-UHFFFAOYSA-N
MW486.19 g/mol
LogP7.86
Rot. Bonds3

About [4-[2-(4-tert-butylnaphthalen-2-yl)-5-methyl-4-pyridinyl]-3-fluorophenyl]-trimethylgermane

[4-[2-(4-tert-butylnaphthalen-2-yl)-5-methyl-4-pyridinyl]-3-fluorophenyl]-trimethylgermane (PubChem CID 171764447) has the molecular formula C29H32FGeN and a molecular weight of 486.19 g/mol. Its IUPAC name is [4-[2-(4-tert-butylnaphthalen-2-yl)-5-methyl-4-pyridinyl]-3-fluorophenyl]-trimethylgermane.

Molecular Properties

Compound Name[4-[2-(4-tert-butylnaphthalen-2-yl)-5-methyl-4-pyridinyl]-3-fluorophenyl]-trimethylgermane
PubChem CID171764447
Molecular FormulaC29H32FGeN
Molecular Weight486.19 g/mol
Exact Mass487.17
IUPAC Name[4-[2-(4-tert-butylnaphthalen-2-yl)-5-methyl-4-pyridinyl]-3-fluorophenyl]-trimethylgermane
SMILESCc1cnc(-c2cc(C(C)(C)C)c3ccccc3c2)cc1-c1ccc([Ge](C)(C)C)cc1F
InChIInChI=1S/C29H32FGeN/c1-19-18-32-28(17-25(19)24-13-12-22(16-27(24)30)31(5,6)7)21-14-20-10-8-9-11-23(20)26(15-21)29(2,3)4/h8-18H,1-7H3
InChIKeyLXFLWUZPKSSPIS-UHFFFAOYSA-N
XLogP7.86
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500486.19
LogP ≤ 57.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

[4-[2-(4-tert-butylnaphthalen-2-yl)-5-methyl-4-pyridinyl]-3-methylphenyl]-trimethylgermane
CID 171764411
[3-fluoro-4-[5-fluoro-2-(4-methylnaphthalen-2-yl)-4-pyridinyl]phenyl]-trimethylgermane
CID 171764500
[2-(4-tert-butylnaphthalen-2-yl)-5-methyl-4-pyridinyl]-trimethylgermane
CID 177122651
[3-fluoro-4-[2-(4-propan-2-ylnaphthalen-2-yl)-5-(trifluoromethyl)-4-pyridinyl]phenyl]-trimethylgermane
CID 171764482
2-[2-(4-tert-butylnaphthalen-2-yl)-5-methyl-4-pyridinyl]-1,3-benzothiazole
CID 156665521
[4-[2-(4-tert-butylnaphthalen-2-yl)-4-pyridinyl]phenyl]-trimethylgermane
CID 171764449
[4-[1-(4-tert-butylnaphthalen-2-yl)-9,9-dimethyl-[1]benzosilolo[2,3-c]pyridin-7-yl]-3-methylphenyl]-trimethylgermane
CID 171747913
[2-[2-(4-tert-butylnaphthalen-2-yl)-4-pyridinyl]-1-benzofuran-5-yl]-trimethylgermane
CID 168743775
[1-(4-tert-butylnaphthalen-2-yl)-9,9-dimethyl-[1]benzosilolo[2,3-c]pyridin-7-yl]-trimethylgermane
CID 171747954
[1-(4-tert-butylnaphthalen-2-yl)-[1]benzofuro[2,3-c]pyridin-6-yl]-trimethylgermane
CID 166018616
[2-(4-tert-butylnaphthalen-2-yl)pyrimidin-4-yl]-trimethylgermane
CID 177122636
[4-[7-(4-tert-butylnaphthalen-2-yl)-3-methylfuro[2,3-c]pyridin-2-yl]phenyl]-trimethylgermane
CID 168743416

Frequently Asked Questions

What is the IUPAC name of [4-[2-(4-tert-butylnaphthalen-2-yl)-5-methyl-4-pyridinyl]-3-fluorophenyl]-trimethylgermane?
The IUPAC name of [4-[2-(4-tert-butylnaphthalen-2-yl)-5-methyl-4-pyridinyl]-3-fluorophenyl]-trimethylgermane (CID 171764447) is [4-[2-(4-tert-butylnaphthalen-2-yl)-5-methyl-4-pyridinyl]-3-fluorophenyl]-trimethylgermane.
What is the SMILES notation for [4-[2-(4-tert-butylnaphthalen-2-yl)-5-methyl-4-pyridinyl]-3-fluorophenyl]-trimethylgermane?
The canonical SMILES for [4-[2-(4-tert-butylnaphthalen-2-yl)-5-methyl-4-pyridinyl]-3-fluorophenyl]-trimethylgermane is Cc1cnc(-c2cc(C(C)(C)C)c3ccccc3c2)cc1-c1ccc([Ge](C)(C)C)cc1F.
What is the InChIKey of [4-[2-(4-tert-butylnaphthalen-2-yl)-5-methyl-4-pyridinyl]-3-fluorophenyl]-trimethylgermane?
The InChIKey is LXFLWUZPKSSPIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H32FGeN/c1-19-18-32-28(17-25(19)24-13-12-22(16-27(24)30)31(5,6)7)21-14-20-10-8-9-11-23(20)26(15-21)29(2,3)4/h8-18H,1-7H3.
What are the key properties of [4-[2-(4-tert-butylnaphthalen-2-yl)-5-methyl-4-pyridinyl]-3-fluorophenyl]-trimethylgermane?
[4-[2-(4-tert-butylnaphthalen-2-yl)-5-methyl-4-pyridinyl]-3-fluorophenyl]-trimethylgermane has a molecular weight of 486.19 g/mol, XLogP of 7.86, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[2-(4-tert-butylnaphthalen-2-yl)-5-methyl-4-pyridinyl]-3-fluorophenyl]-trimethylgermane is sourced from PubChem (CID 171764447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).