3-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]-1H-indazole

C17H19N5 — CID 167350617

IUPAC3-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]-1H-indazole
SMILESCN1CCN(c2ccc(-c3n[nH]c4ccccc34)nc2)CC1
InChIInChI=1S/C17H19N5/c1-21-8-10-22(11-9-21)13-6-7-16(18-12-13)17-14-4-2-3-5-15(14)19-20-17/h2-7,12H,8-11H2,1H3,(H,19,20)
InChIKeyWSIUCADQJMDHJO-UHFFFAOYSA-N
MW293.37 g/mol
LogP2.38
Rot. Bonds2

About 3-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]-1H-indazole

3-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]-1H-indazole (PubChem CID 167350617) has the molecular formula C17H19N5 and a molecular weight of 293.37 g/mol. Its IUPAC name is 3-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]-1H-indazole.

Molecular Properties

Compound Name3-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]-1H-indazole
PubChem CID167350617
Molecular FormulaC17H19N5
Molecular Weight293.37 g/mol
Exact Mass293.16
IUPAC Name3-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]-1H-indazole
SMILESCN1CCN(c2ccc(-c3n[nH]c4ccccc34)nc2)CC1
InChIInChI=1S/C17H19N5/c1-21-8-10-22(11-9-21)13-6-7-16(18-12-13)17-14-4-2-3-5-15(14)19-20-17/h2-7,12H,8-11H2,1H3,(H,19,20)
InChIKeyWSIUCADQJMDHJO-UHFFFAOYSA-N
XLogP2.38
TPSA48.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]-1H-indazole 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 3-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]-1H-indazole?
The IUPAC name of 3-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]-1H-indazole (CID 167350617) is 3-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]-1H-indazole.
What is the SMILES notation for 3-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]-1H-indazole?
The canonical SMILES for 3-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]-1H-indazole is CN1CCN(c2ccc(-c3n[nH]c4ccccc34)nc2)CC1.
What is the InChIKey of 3-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]-1H-indazole?
The InChIKey is WSIUCADQJMDHJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N5/c1-21-8-10-22(11-9-21)13-6-7-16(18-12-13)17-14-4-2-3-5-15(14)19-20-17/h2-7,12H,8-11H2,1H3,(H,19,20).
What are the key properties of 3-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]-1H-indazole?
3-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]-1H-indazole has a molecular weight of 293.37 g/mol, XLogP of 2.38, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]-1H-indazole is sourced from PubChem (CID 167350617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).