3-ethyl-N-methyl-4,5,6,7-tetrahydro-1H-indazol-4-amine

C10H17N3 — CID 83861924

IUPAC3-ethyl-N-methyl-4,5,6,7-tetrahydro-1H-indazol-4-amine
SMILESCCc1n[nH]c2c1C(NC)CCC2
InChIInChI=1S/C10H17N3/c1-3-7-10-8(11-2)5-4-6-9(10)13-12-7/h8,11H,3-6H2,1-2H3,(H,12,13)
InChIKeyWFQUERSZYDBNJU-UHFFFAOYSA-N
MW179.27 g/mol
LogP1.57
Rot. Bonds2

About 3-ethyl-N-methyl-4,5,6,7-tetrahydro-1H-indazol-4-amine

3-ethyl-N-methyl-4,5,6,7-tetrahydro-1H-indazol-4-amine (PubChem CID 83861924) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is 3-ethyl-N-methyl-4,5,6,7-tetrahydro-1H-indazol-4-amine.

Molecular Properties

Compound Name3-ethyl-N-methyl-4,5,6,7-tetrahydro-1H-indazol-4-amine
PubChem CID83861924
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC Name3-ethyl-N-methyl-4,5,6,7-tetrahydro-1H-indazol-4-amine
SMILESCCc1n[nH]c2c1C(NC)CCC2
InChIInChI=1S/C10H17N3/c1-3-7-10-8(11-2)5-4-6-9(10)13-12-7/h8,11H,3-6H2,1-2H3,(H,12,13)
InChIKeyWFQUERSZYDBNJU-UHFFFAOYSA-N
XLogP1.57
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-methyl-4,5,6,7-tetrahydro-1H-indazol-4-amine?
The IUPAC name of 3-ethyl-N-methyl-4,5,6,7-tetrahydro-1H-indazol-4-amine (CID 83861924) is 3-ethyl-N-methyl-4,5,6,7-tetrahydro-1H-indazol-4-amine.
What is the SMILES notation for 3-ethyl-N-methyl-4,5,6,7-tetrahydro-1H-indazol-4-amine?
The canonical SMILES for 3-ethyl-N-methyl-4,5,6,7-tetrahydro-1H-indazol-4-amine is CCc1n[nH]c2c1C(NC)CCC2.
What is the InChIKey of 3-ethyl-N-methyl-4,5,6,7-tetrahydro-1H-indazol-4-amine?
The InChIKey is WFQUERSZYDBNJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-3-7-10-8(11-2)5-4-6-9(10)13-12-7/h8,11H,3-6H2,1-2H3,(H,12,13).
What are the key properties of 3-ethyl-N-methyl-4,5,6,7-tetrahydro-1H-indazol-4-amine?
3-ethyl-N-methyl-4,5,6,7-tetrahydro-1H-indazol-4-amine has a molecular weight of 179.27 g/mol, XLogP of 1.57, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-methyl-4,5,6,7-tetrahydro-1H-indazol-4-amine is sourced from PubChem (CID 83861924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).