3,5-dichloro-2-ethylindazole

C9H8Cl2N2 — CID 84723698

IUPAC3,5-dichloro-2-ethylindazole
SMILESCCn1nc2ccc(Cl)cc2c1Cl
InChIInChI=1S/C9H8Cl2N2/c1-2-13-9(11)7-5-6(10)3-4-8(7)12-13/h3-5H,2H2,1H3
InChIKeyNHGQUXDRXCHGNZ-UHFFFAOYSA-N
MW215.08 g/mol
LogP3.36
Rot. Bonds1

About 3,5-dichloro-2-ethylindazole

3,5-dichloro-2-ethylindazole (PubChem CID 84723698) has the molecular formula C9H8Cl2N2 and a molecular weight of 215.08 g/mol. Its IUPAC name is 3,5-dichloro-2-ethylindazole.

Molecular Properties

Compound Name3,5-dichloro-2-ethylindazole
PubChem CID84723698
Molecular FormulaC9H8Cl2N2
Molecular Weight215.08 g/mol
Exact Mass214.01
IUPAC Name3,5-dichloro-2-ethylindazole
SMILESCCn1nc2ccc(Cl)cc2c1Cl
InChIInChI=1S/C9H8Cl2N2/c1-2-13-9(11)7-5-6(10)3-4-8(7)12-13/h3-5H,2H2,1H3
InChIKeyNHGQUXDRXCHGNZ-UHFFFAOYSA-N
XLogP3.36
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.08
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3,4-dichlorophenyl)-1-(1-methylindazol-5-yl)methanimine
CID 77844772
1-(2-chlorobenzyl)-3,5-dimethyl-1H-pyrazole
CID 661809
1-Methyl-1H-indazole
CID 139456
4-(4-Chloro-phenyl)-1,2-dihydro-3,9,9a-triaza-fluorene 9-oxide
CID 24982649
(2S)-1-(5,6-dichloroindazol-1-yl)propan-2-amine
CID 44452832
1-[(4-chloro-1-methyl-1H-indazol-3-yl)methyl]azepan-3-amine
CID 70709825
2-(3-Chlorophenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
CID 71814121
3-(5-Chloroindazol-1-yl)propanoic acid
CID 84689388
1-(3-chlorobenzyl)-1H-indazole
CID 20425690
1-(2-chloro-6-fluorobenzyl)-1H-indazole
CID 20425687
Methyl 2-(5-chloro-3-phenylindazol-1-yl)acetate
CID 9551137
(5-Chloro-indol-1-yl)-propyl-pyridin-4-yl-amine
CID 10755592

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-2-ethylindazole?
The IUPAC name of 3,5-dichloro-2-ethylindazole (CID 84723698) is 3,5-dichloro-2-ethylindazole.
What is the SMILES notation for 3,5-dichloro-2-ethylindazole?
The canonical SMILES for 3,5-dichloro-2-ethylindazole is CCn1nc2ccc(Cl)cc2c1Cl.
What is the InChIKey of 3,5-dichloro-2-ethylindazole?
The InChIKey is NHGQUXDRXCHGNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8Cl2N2/c1-2-13-9(11)7-5-6(10)3-4-8(7)12-13/h3-5H,2H2,1H3.
What are the key properties of 3,5-dichloro-2-ethylindazole?
3,5-dichloro-2-ethylindazole has a molecular weight of 215.08 g/mol, XLogP of 3.36, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-2-ethylindazole is sourced from PubChem (CID 84723698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).