N,1,3-trimethyl-4,5,6,7-tetrahydroindazol-4-amine

C10H17N3 — CID 83861915

IUPACN,1,3-trimethyl-4,5,6,7-tetrahydroindazol-4-amine
SMILESCNC1CCCc2c1c(C)nn2C
InChIInChI=1S/C10H17N3/c1-7-10-8(11-2)5-4-6-9(10)13(3)12-7/h8,11H,4-6H2,1-3H3
InChIKeyWRINYAHPEVJCMO-UHFFFAOYSA-N
MW179.27 g/mol
LogP1.33
Rot. Bonds1

About N,1,3-trimethyl-4,5,6,7-tetrahydroindazol-4-amine

N,1,3-trimethyl-4,5,6,7-tetrahydroindazol-4-amine (PubChem CID 83861915) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is N,1,3-trimethyl-4,5,6,7-tetrahydroindazol-4-amine.

Molecular Properties

Compound NameN,1,3-trimethyl-4,5,6,7-tetrahydroindazol-4-amine
PubChem CID83861915
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC NameN,1,3-trimethyl-4,5,6,7-tetrahydroindazol-4-amine
SMILESCNC1CCCc2c1c(C)nn2C
InChIInChI=1S/C10H17N3/c1-7-10-8(11-2)5-4-6-9(10)13(3)12-7/h8,11H,4-6H2,1-3H3
InChIKeyWRINYAHPEVJCMO-UHFFFAOYSA-N
XLogP1.33
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,1,3-trimethyl-4,5,6,7-tetrahydroindazol-4-amine?
The IUPAC name of N,1,3-trimethyl-4,5,6,7-tetrahydroindazol-4-amine (CID 83861915) is N,1,3-trimethyl-4,5,6,7-tetrahydroindazol-4-amine.
What is the SMILES notation for N,1,3-trimethyl-4,5,6,7-tetrahydroindazol-4-amine?
The canonical SMILES for N,1,3-trimethyl-4,5,6,7-tetrahydroindazol-4-amine is CNC1CCCc2c1c(C)nn2C.
What is the InChIKey of N,1,3-trimethyl-4,5,6,7-tetrahydroindazol-4-amine?
The InChIKey is WRINYAHPEVJCMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-7-10-8(11-2)5-4-6-9(10)13(3)12-7/h8,11H,4-6H2,1-3H3.
What are the key properties of N,1,3-trimethyl-4,5,6,7-tetrahydroindazol-4-amine?
N,1,3-trimethyl-4,5,6,7-tetrahydroindazol-4-amine has a molecular weight of 179.27 g/mol, XLogP of 1.33, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,1,3-trimethyl-4,5,6,7-tetrahydroindazol-4-amine is sourced from PubChem (CID 83861915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).