N-(5-methyl-3-piperidin-1-ylhexyl)-1H-indazol-3-amine

C19H30N4 — CID 3021347

IUPACN-(5-methyl-3-piperidin-1-ylhexyl)-1H-indazol-3-amine
SMILESCC(C)CC(CCNc1n[nH]c2ccccc12)N1CCCCC1
InChIInChI=1S/C19H30N4/c1-15(2)14-16(23-12-6-3-7-13-23)10-11-20-19-17-8-4-5-9-18(17)21-22-19/h4-5,8-9,15-16H,3,6-7,10-14H2,1-2H3,(H2,20,21,22)
InChIKeyXFXBHOVYUBIUIK-UHFFFAOYSA-N
MW314.48 g/mol
LogP4.27
Rot. Bonds7

About N-(5-methyl-3-piperidin-1-ylhexyl)-1H-indazol-3-amine

N-(5-methyl-3-piperidin-1-ylhexyl)-1H-indazol-3-amine (PubChem CID 3021347) has the molecular formula C19H30N4 and a molecular weight of 314.48 g/mol. Its IUPAC name is N-(5-methyl-3-piperidin-1-ylhexyl)-1H-indazol-3-amine.

Molecular Properties

Compound NameN-(5-methyl-3-piperidin-1-ylhexyl)-1H-indazol-3-amine
PubChem CID3021347
Molecular FormulaC19H30N4
Molecular Weight314.48 g/mol
Exact Mass314.25
IUPAC NameN-(5-methyl-3-piperidin-1-ylhexyl)-1H-indazol-3-amine
SMILESCC(C)CC(CCNc1n[nH]c2ccccc12)N1CCCCC1
InChIInChI=1S/C19H30N4/c1-15(2)14-16(23-12-6-3-7-13-23)10-11-20-19-17-8-4-5-9-18(17)21-22-19/h4-5,8-9,15-16H,3,6-7,10-14H2,1-2H3,(H2,20,21,22)
InChIKeyXFXBHOVYUBIUIK-UHFFFAOYSA-N
XLogP4.27
TPSA43.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.48
LogP ≤ 54.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(5-methyl-3-piperidin-1-ylhexyl)-1H-indazol-3-amine 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 N-(5-methyl-3-piperidin-1-ylhexyl)-1H-indazol-3-amine?
The IUPAC name of N-(5-methyl-3-piperidin-1-ylhexyl)-1H-indazol-3-amine (CID 3021347) is N-(5-methyl-3-piperidin-1-ylhexyl)-1H-indazol-3-amine.
What is the SMILES notation for N-(5-methyl-3-piperidin-1-ylhexyl)-1H-indazol-3-amine?
The canonical SMILES for N-(5-methyl-3-piperidin-1-ylhexyl)-1H-indazol-3-amine is CC(C)CC(CCNc1n[nH]c2ccccc12)N1CCCCC1.
What is the InChIKey of N-(5-methyl-3-piperidin-1-ylhexyl)-1H-indazol-3-amine?
The InChIKey is XFXBHOVYUBIUIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N4/c1-15(2)14-16(23-12-6-3-7-13-23)10-11-20-19-17-8-4-5-9-18(17)21-22-19/h4-5,8-9,15-16H,3,6-7,10-14H2,1-2H3,(H2,20,21,22).
What are the key properties of N-(5-methyl-3-piperidin-1-ylhexyl)-1H-indazol-3-amine?
N-(5-methyl-3-piperidin-1-ylhexyl)-1H-indazol-3-amine has a molecular weight of 314.48 g/mol, XLogP of 4.27, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-3-piperidin-1-ylhexyl)-1H-indazol-3-amine is sourced from PubChem (CID 3021347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).