(1S)-1-(4,5,6,7-tetrahydro-1H-indazol-3-yl)ethanamine

C9H15N3 — CID 82414484

IUPAC(1S)-1-(4,5,6,7-tetrahydro-1H-indazol-3-yl)ethanamine
SMILESC[C@H](N)c1n[nH]c2c1CCCC2
InChIInChI=1S/C9H15N3/c1-6(10)9-7-4-2-3-5-8(7)11-12-9/h6H,2-5,10H2,1H3,(H,11,12)/t6-/m0/s1
InChIKeySRIBTQQZZYHMEJ-LURJTMIESA-N
MW165.24 g/mol
LogP1.31
Rot. Bonds1

About (1S)-1-(4,5,6,7-tetrahydro-1H-indazol-3-yl)ethanamine

(1S)-1-(4,5,6,7-tetrahydro-1H-indazol-3-yl)ethanamine (PubChem CID 82414484) has the molecular formula C9H15N3 and a molecular weight of 165.24 g/mol. Its IUPAC name is (1S)-1-(4,5,6,7-tetrahydro-1H-indazol-3-yl)ethanamine.

Molecular Properties

Compound Name(1S)-1-(4,5,6,7-tetrahydro-1H-indazol-3-yl)ethanamine
PubChem CID82414484
Molecular FormulaC9H15N3
Molecular Weight165.24 g/mol
Exact Mass165.13
IUPAC Name(1S)-1-(4,5,6,7-tetrahydro-1H-indazol-3-yl)ethanamine
SMILESC[C@H](N)c1n[nH]c2c1CCCC2
InChIInChI=1S/C9H15N3/c1-6(10)9-7-4-2-3-5-8(7)11-12-9/h6H,2-5,10H2,1H3,(H,11,12)/t6-/m0/s1
InChIKeySRIBTQQZZYHMEJ-LURJTMIESA-N
XLogP1.31
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (1S)-1-(4,5,6,7-tetrahydro-1H-indazol-3-yl)ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (1S)-1-(4,5,6,7-tetrahydro-1H-indazol-3-yl)ethanamine?
The IUPAC name of (1S)-1-(4,5,6,7-tetrahydro-1H-indazol-3-yl)ethanamine (CID 82414484) is (1S)-1-(4,5,6,7-tetrahydro-1H-indazol-3-yl)ethanamine.
What is the SMILES notation for (1S)-1-(4,5,6,7-tetrahydro-1H-indazol-3-yl)ethanamine?
The canonical SMILES for (1S)-1-(4,5,6,7-tetrahydro-1H-indazol-3-yl)ethanamine is C[C@H](N)c1n[nH]c2c1CCCC2.
What is the InChIKey of (1S)-1-(4,5,6,7-tetrahydro-1H-indazol-3-yl)ethanamine?
The InChIKey is SRIBTQQZZYHMEJ-LURJTMIESA-N. The full InChI is InChI=1S/C9H15N3/c1-6(10)9-7-4-2-3-5-8(7)11-12-9/h6H,2-5,10H2,1H3,(H,11,12)/t6-/m0/s1.
What are the key properties of (1S)-1-(4,5,6,7-tetrahydro-1H-indazol-3-yl)ethanamine?
(1S)-1-(4,5,6,7-tetrahydro-1H-indazol-3-yl)ethanamine has a molecular weight of 165.24 g/mol, XLogP of 1.31, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-(4,5,6,7-tetrahydro-1H-indazol-3-yl)ethanamine is sourced from PubChem (CID 82414484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).