[3-(6-tert-butyl-[1]benzofuro[2,3-b]pyridin-8-yl)benzo[f]quinolin-1-yl]-trimethylgermane

C31H30GeN2O — CID 140916532

IUPAC[3-(6-tert-butyl-[1]benzofuro[2,3-b]pyridin-8-yl)benzo[f]quinolin-1-yl]-trimethylgermane
SMILESCC(C)(C)c1cc(-c2cc([Ge](C)(C)C)c3c(ccc4ccccc43)n2)c2oc3ncccc3c2c1
InChIInChI=1S/C31H30GeN2O/c1-31(2,3)20-16-23-22-12-9-15-33-30(22)35-29(23)24(17-20)27-18-25(32(4,5)6)28-21-11-8-7-10-19(21)13-14-26(28)34-27/h7-18H,1-6H3
InChIKeyNXSIUVXCRWKXGH-UHFFFAOYSA-N
MW519.20 g/mol
LogP8.19
Rot. Bonds2

About [3-(6-tert-butyl-[1]benzofuro[2,3-b]pyridin-8-yl)benzo[f]quinolin-1-yl]-trimethylgermane

[3-(6-tert-butyl-[1]benzofuro[2,3-b]pyridin-8-yl)benzo[f]quinolin-1-yl]-trimethylgermane (PubChem CID 140916532) has the molecular formula C31H30GeN2O and a molecular weight of 519.20 g/mol. Its IUPAC name is [3-(6-tert-butyl-[1]benzofuro[2,3-b]pyridin-8-yl)benzo[f]quinolin-1-yl]-trimethylgermane.

Molecular Properties

Compound Name[3-(6-tert-butyl-[1]benzofuro[2,3-b]pyridin-8-yl)benzo[f]quinolin-1-yl]-trimethylgermane
PubChem CID140916532
Molecular FormulaC31H30GeN2O
Molecular Weight519.20 g/mol
Exact Mass520.16
IUPAC Name[3-(6-tert-butyl-[1]benzofuro[2,3-b]pyridin-8-yl)benzo[f]quinolin-1-yl]-trimethylgermane
SMILESCC(C)(C)c1cc(-c2cc([Ge](C)(C)C)c3c(ccc4ccccc43)n2)c2oc3ncccc3c2c1
InChIInChI=1S/C31H30GeN2O/c1-31(2,3)20-16-23-22-12-9-15-33-30(22)35-29(23)24(17-20)27-18-25(32(4,5)6)28-21-11-8-7-10-19(21)13-14-26(28)34-27/h7-18H,1-6H3
InChIKeyNXSIUVXCRWKXGH-UHFFFAOYSA-N
XLogP8.19
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms35
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500519.20
LogP ≤ 58.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze [3-(6-tert-butyl-[1]benzofuro[2,3-b]pyridin-8-yl)benzo[f]quinolin-1-yl]-trimethylgermane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-tert-butyl-8-(1-phenylbenzo[f]quinolin-3-yl)-[1]benzofuro[2,3-b]pyridine
CID 140916361
3-(2-tert-butyldibenzofuran-4-yl)-1-phenylbenzo[f]quinoline
CID 140916344
8-(1-cyclopentylbenzo[f]quinolin-3-yl)-[1]benzofuro[2,3-b]pyridine
CID 140916393
8-(1-tert-butylbenzo[e]benzimidazol-2-yl)-5-methyl-[1]benzofuro[2,3-b]pyridine
CID 156668121
3-(2-tert-butyldibenzothiophen-4-yl)-1-(2-methylpropyl)benzo[f]quinoline
CID 140916405
7-tert-butyl-8-methyl-[1]benzofuro[2,3-b]pyridine
CID 153286236
6-pyridin-2-yl-8-oxa-4,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene
CID 171768052
8-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-10-oxa-12-azapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1,3(11),4(9),5,7,12,14,16,18,20-decaene
CID 162708303
4-([1]benzofuro[2,3-b]pyridin-8-yl)-N,N-bis(4-cinnolin-3-ylphenyl)aniline
CID 168765748
2-tert-butyl-8-[4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]-2-pyridinyl]-[1]benzofuro[2,3-b]pyridine
CID 155611964
[4-([1]benzofuro[2,3-b]pyridin-8-yl)-10-methylbenzo[h]quinazolin-8-yl]-trimethylgermane
CID 176722779
2,6-dimethyl-8-[4-(3,3,3-trifluoro-2,2-dimethylpropyl)quinolin-2-yl]-[1]benzofuro[2,3-b]pyridine
CID 170140370

Frequently Asked Questions

What is the IUPAC name of [3-(6-tert-butyl-[1]benzofuro[2,3-b]pyridin-8-yl)benzo[f]quinolin-1-yl]-trimethylgermane?
The IUPAC name of [3-(6-tert-butyl-[1]benzofuro[2,3-b]pyridin-8-yl)benzo[f]quinolin-1-yl]-trimethylgermane (CID 140916532) is [3-(6-tert-butyl-[1]benzofuro[2,3-b]pyridin-8-yl)benzo[f]quinolin-1-yl]-trimethylgermane.
What is the SMILES notation for [3-(6-tert-butyl-[1]benzofuro[2,3-b]pyridin-8-yl)benzo[f]quinolin-1-yl]-trimethylgermane?
The canonical SMILES for [3-(6-tert-butyl-[1]benzofuro[2,3-b]pyridin-8-yl)benzo[f]quinolin-1-yl]-trimethylgermane is CC(C)(C)c1cc(-c2cc([Ge](C)(C)C)c3c(ccc4ccccc43)n2)c2oc3ncccc3c2c1.
What is the InChIKey of [3-(6-tert-butyl-[1]benzofuro[2,3-b]pyridin-8-yl)benzo[f]quinolin-1-yl]-trimethylgermane?
The InChIKey is NXSIUVXCRWKXGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H30GeN2O/c1-31(2,3)20-16-23-22-12-9-15-33-30(22)35-29(23)24(17-20)27-18-25(32(4,5)6)28-21-11-8-7-10-19(21)13-14-26(28)34-27/h7-18H,1-6H3.
What are the key properties of [3-(6-tert-butyl-[1]benzofuro[2,3-b]pyridin-8-yl)benzo[f]quinolin-1-yl]-trimethylgermane?
[3-(6-tert-butyl-[1]benzofuro[2,3-b]pyridin-8-yl)benzo[f]quinolin-1-yl]-trimethylgermane has a molecular weight of 519.20 g/mol, XLogP of 8.19, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(6-tert-butyl-[1]benzofuro[2,3-b]pyridin-8-yl)benzo[f]quinolin-1-yl]-trimethylgermane is sourced from PubChem (CID 140916532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).