3,5-diethyl-2,7-dimethylindazole

C13H18N2 — CID 144991197

IUPAC3,5-diethyl-2,7-dimethylindazole
SMILESCCc1cc(C)c2nn(C)c(CC)c2c1
InChIInChI=1S/C13H18N2/c1-5-10-7-9(3)13-11(8-10)12(6-2)15(4)14-13/h7-8H,5-6H2,1-4H3
InChIKeyXPOLLHGQEYZLFI-UHFFFAOYSA-N
MW202.30 g/mol
LogP3.01
Rot. Bonds2

About 3,5-diethyl-2,7-dimethylindazole

3,5-diethyl-2,7-dimethylindazole (PubChem CID 144991197) has the molecular formula C13H18N2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 3,5-diethyl-2,7-dimethylindazole.

Molecular Properties

Compound Name3,5-diethyl-2,7-dimethylindazole
PubChem CID144991197
Molecular FormulaC13H18N2
Molecular Weight202.30 g/mol
Exact Mass202.15
IUPAC Name3,5-diethyl-2,7-dimethylindazole
SMILESCCc1cc(C)c2nn(C)c(CC)c2c1
InChIInChI=1S/C13H18N2/c1-5-10-7-9(3)13-11(8-10)12(6-2)15(4)14-13/h7-8H,5-6H2,1-4H3
InChIKeyXPOLLHGQEYZLFI-UHFFFAOYSA-N
XLogP3.01
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5,7-dichloro-3-ethyl-2-methylindazole
CID 59514266
5-bromo-3-ethyl-7-fluoro-2-methylindazole
CID 59514186
3-ethyl-2-methylindazol-7-amine
CID 105436213
6-ethyl-2,4-dimethyl-1-propan-2-ylbenzimidazole
CID 156802411
3,5-diethyl-1,4-dimethylpyrazole
CID 44720131
5-ethyl-1,4-dimethylpyrazol-3-amine
CID 83815114
3-ethyl-2-methyl-6-(trifluoromethyl)indazole
CID 59514322
6-ethyl-2,8-dimethylquinoxaline
CID 134416600
3-ethyl-2-methylindazole-5-carbaldehyde
CID 105443073
5-ethyl-2-(2-methoxyethoxy)-1,3-dimethylbenzene
CID 174787766
4-ethyl-2,6-dimethylphenol;methane
CID 159618487
ethane;4-ethyl-2,6-dimethylphenol
CID 143343408

Frequently Asked Questions

What is the IUPAC name of 3,5-diethyl-2,7-dimethylindazole?
The IUPAC name of 3,5-diethyl-2,7-dimethylindazole (CID 144991197) is 3,5-diethyl-2,7-dimethylindazole.
What is the SMILES notation for 3,5-diethyl-2,7-dimethylindazole?
The canonical SMILES for 3,5-diethyl-2,7-dimethylindazole is CCc1cc(C)c2nn(C)c(CC)c2c1.
What is the InChIKey of 3,5-diethyl-2,7-dimethylindazole?
The InChIKey is XPOLLHGQEYZLFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2/c1-5-10-7-9(3)13-11(8-10)12(6-2)15(4)14-13/h7-8H,5-6H2,1-4H3.
What are the key properties of 3,5-diethyl-2,7-dimethylindazole?
3,5-diethyl-2,7-dimethylindazole has a molecular weight of 202.30 g/mol, XLogP of 3.01, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-diethyl-2,7-dimethylindazole is sourced from PubChem (CID 144991197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).