ethane;4-ethyl-2-(4-methylphenyl)indazole

C18H22N2 — CID 123901665

IUPACethane;4-ethyl-2-(4-methylphenyl)indazole
SMILESCC.CCc1cccc2nn(-c3ccc(C)cc3)cc12
InChIInChI=1S/C16H16N2.C2H6/c1-3-13-5-4-6-16-15(13)11-18(17-16)14-9-7-12(2)8-10-14;1-2/h4-11H,3H2,1-2H3;1-2H3
InChIKeyPTGRATPODPLJFK-UHFFFAOYSA-N
MW266.39 g/mol
LogP4.92
Rot. Bonds2

About ethane;4-ethyl-2-(4-methylphenyl)indazole

ethane;4-ethyl-2-(4-methylphenyl)indazole (PubChem CID 123901665) has the molecular formula C18H22N2 and a molecular weight of 266.39 g/mol. Its IUPAC name is ethane;4-ethyl-2-(4-methylphenyl)indazole.

Molecular Properties

Compound Nameethane;4-ethyl-2-(4-methylphenyl)indazole
PubChem CID123901665
Molecular FormulaC18H22N2
Molecular Weight266.39 g/mol
Exact Mass266.18
IUPAC Nameethane;4-ethyl-2-(4-methylphenyl)indazole
SMILESCC.CCc1cccc2nn(-c3ccc(C)cc3)cc12
InChIInChI=1S/C16H16N2.C2H6/c1-3-13-5-4-6-16-15(13)11-18(17-16)14-9-7-12(2)8-10-14;1-2/h4-11H,3H2,1-2H3;1-2H3
InChIKeyPTGRATPODPLJFK-UHFFFAOYSA-N
XLogP4.92
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 54.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze ethane;4-ethyl-2-(4-methylphenyl)indazole 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

4-ethyl-2-(2-methylpropyl)indazole
CID 176962726
2-(4-methylphenyl)-4-pyridin-1-ium-1-ylpyrazolo[3,4-c]quinoline
CID 11793694
ethane;1-ethyl-7-methylnaphthalene
CID 91014752
ethane;5-ethylquinoline
CID 143401043
2-(4-methylphenyl)-4,6-dinitroindazole
CID 626844
ethane;2-ethyl-3-(4-methylphenyl)quinazolin-4-one
CID 90844218
ethane;1-ethyl-6-methylnaphthalene
CID 91003856
[1-(4-ethylphenyl)-3-(4-methylphenyl)pyrazol-4-yl]methanamine
CID 28910884
bis(2,6-diethylphenol);1,4-xylene
CID 160641052
1-ethyl-7-methylnaphthalene
CID 12778771
[3-bromo-1-(4-methylphenyl)pyrazol-4-yl]methanol
CID 165072337
2-chloro-5-ethylquinoline;ethane
CID 143687373

Frequently Asked Questions

What is the IUPAC name of ethane;4-ethyl-2-(4-methylphenyl)indazole?
The IUPAC name of ethane;4-ethyl-2-(4-methylphenyl)indazole (CID 123901665) is ethane;4-ethyl-2-(4-methylphenyl)indazole.
What is the SMILES notation for ethane;4-ethyl-2-(4-methylphenyl)indazole?
The canonical SMILES for ethane;4-ethyl-2-(4-methylphenyl)indazole is CC.CCc1cccc2nn(-c3ccc(C)cc3)cc12.
What is the InChIKey of ethane;4-ethyl-2-(4-methylphenyl)indazole?
The InChIKey is PTGRATPODPLJFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2.C2H6/c1-3-13-5-4-6-16-15(13)11-18(17-16)14-9-7-12(2)8-10-14;1-2/h4-11H,3H2,1-2H3;1-2H3.
What are the key properties of ethane;4-ethyl-2-(4-methylphenyl)indazole?
ethane;4-ethyl-2-(4-methylphenyl)indazole has a molecular weight of 266.39 g/mol, XLogP of 4.92, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-ethyl-2-(4-methylphenyl)indazole is sourced from PubChem (CID 123901665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).