7-chloro-3-ethyl-5-methyl-2H-indazole

C10H11ClN2 — CID 89021099

IUPAC7-chloro-3-ethyl-5-methyl-2H-indazole
SMILESCCc1[nH]nc2c(Cl)cc(C)cc12
InChIInChI=1S/C10H11ClN2/c1-3-9-7-4-6(2)5-8(11)10(7)13-12-9/h4-5H,3H2,1-2H3,(H,12,13)
InChIKeyLTNSYZDMJIHONF-UHFFFAOYSA-N
MW194.66 g/mol
LogP3.09
Rot. Bonds1

About 7-chloro-3-ethyl-5-methyl-2H-indazole

7-chloro-3-ethyl-5-methyl-2H-indazole (PubChem CID 89021099) has the molecular formula C10H11ClN2 and a molecular weight of 194.66 g/mol. Its IUPAC name is 7-chloro-3-ethyl-5-methyl-2H-indazole.

Molecular Properties

Compound Name7-chloro-3-ethyl-5-methyl-2H-indazole
PubChem CID89021099
Molecular FormulaC10H11ClN2
Molecular Weight194.66 g/mol
Exact Mass194.06
IUPAC Name7-chloro-3-ethyl-5-methyl-2H-indazole
SMILESCCc1[nH]nc2c(Cl)cc(C)cc12
InChIInChI=1S/C10H11ClN2/c1-3-9-7-4-6(2)5-8(11)10(7)13-12-9/h4-5H,3H2,1-2H3,(H,12,13)
InChIKeyLTNSYZDMJIHONF-UHFFFAOYSA-N
XLogP3.09
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.66
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 7-chloro-3-ethyl-5-methyl-2H-indazole?
The IUPAC name of 7-chloro-3-ethyl-5-methyl-2H-indazole (CID 89021099) is 7-chloro-3-ethyl-5-methyl-2H-indazole.
What is the SMILES notation for 7-chloro-3-ethyl-5-methyl-2H-indazole?
The canonical SMILES for 7-chloro-3-ethyl-5-methyl-2H-indazole is CCc1[nH]nc2c(Cl)cc(C)cc12.
What is the InChIKey of 7-chloro-3-ethyl-5-methyl-2H-indazole?
The InChIKey is LTNSYZDMJIHONF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClN2/c1-3-9-7-4-6(2)5-8(11)10(7)13-12-9/h4-5H,3H2,1-2H3,(H,12,13).
What are the key properties of 7-chloro-3-ethyl-5-methyl-2H-indazole?
7-chloro-3-ethyl-5-methyl-2H-indazole has a molecular weight of 194.66 g/mol, XLogP of 3.09, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-3-ethyl-5-methyl-2H-indazole is sourced from PubChem (CID 89021099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).