3-chloro-2-ethylindazol-5-amine

C9H10ClN3 — CID 84720626

IUPAC3-chloro-2-ethylindazol-5-amine
SMILESCCn1nc2ccc(N)cc2c1Cl
InChIInChI=1S/C9H10ClN3/c1-2-13-9(10)7-5-6(11)3-4-8(7)12-13/h3-5H,2,11H2,1H3
InChIKeyMAAREAGAXQBPOH-UHFFFAOYSA-N
MW195.65 g/mol
LogP2.29
Rot. Bonds1

About 3-chloro-2-ethylindazol-5-amine

3-chloro-2-ethylindazol-5-amine (PubChem CID 84720626) has the molecular formula C9H10ClN3 and a molecular weight of 195.65 g/mol. Its IUPAC name is 3-chloro-2-ethylindazol-5-amine.

Molecular Properties

Compound Name3-chloro-2-ethylindazol-5-amine
PubChem CID84720626
Molecular FormulaC9H10ClN3
Molecular Weight195.65 g/mol
Exact Mass195.06
IUPAC Name3-chloro-2-ethylindazol-5-amine
SMILESCCn1nc2ccc(N)cc2c1Cl
InChIInChI=1S/C9H10ClN3/c1-2-13-9(10)7-5-6(11)3-4-8(7)12-13/h3-5H,2,11H2,1H3
InChIKeyMAAREAGAXQBPOH-UHFFFAOYSA-N
XLogP2.29
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.65
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3,5-dichloro-2-ethylindazole
CID 84723698
3-chloro-2-ethyl-5-fluoroindazole
CID 84721028
3-bromo-2-ethylindazol-5-amine
CID 84727982
3-chloro-2-ethylindazol-5-ol
CID 84720798
1-(3-chloro-2-ethylindazol-5-yl)ethanone
CID 84725176
3-bromo-5-chloro-2-ethylindazole
CID 84729523
2-(2-ethyl-5-methylindazol-3-yl)ethanamine
CID 84721659
3,4-dichloro-2-ethylindazole
CID 84723697
4-chloro-2-methylquinazolin-6-amine
CID 124908084
2-(2-ethyl-5-methylpyrazol-3-yl)-1,3-benzoxazol-6-amine
CID 66120071
1-(5-amino-2-bromophenyl)-2-(4-chloro-1-ethyl-3-methylpyrazol-5-yl)ethanone
CID 116602790
3-(1-ethyl-3,5-dimethylpyrazol-4-yl)-4-methylaniline
CID 63805681

Frequently Asked Questions

What is the IUPAC name of 3-chloro-2-ethylindazol-5-amine?
The IUPAC name of 3-chloro-2-ethylindazol-5-amine (CID 84720626) is 3-chloro-2-ethylindazol-5-amine.
What is the SMILES notation for 3-chloro-2-ethylindazol-5-amine?
The canonical SMILES for 3-chloro-2-ethylindazol-5-amine is CCn1nc2ccc(N)cc2c1Cl.
What is the InChIKey of 3-chloro-2-ethylindazol-5-amine?
The InChIKey is MAAREAGAXQBPOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10ClN3/c1-2-13-9(10)7-5-6(11)3-4-8(7)12-13/h3-5H,2,11H2,1H3.
What are the key properties of 3-chloro-2-ethylindazol-5-amine?
3-chloro-2-ethylindazol-5-amine has a molecular weight of 195.65 g/mol, XLogP of 2.29, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-2-ethylindazol-5-amine is sourced from PubChem (CID 84720626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).