1-(3-piperidin-1-ylbutyl)indazol-3-amine

C16H24N4 — CID 3021373

IUPAC1-(3-piperidin-1-ylbutyl)indazol-3-amine
SMILESCC(CCn1nc(N)c2ccccc21)N1CCCCC1
InChIInChI=1S/C16H24N4/c1-13(19-10-5-2-6-11-19)9-12-20-15-8-4-3-7-14(15)16(17)18-20/h3-4,7-8,13H,2,5-6,9-12H2,1H3,(H2,17,18)
InChIKeyHBRMYSQKTBVBHF-UHFFFAOYSA-N
MW272.40 g/mol
LogP2.88
Rot. Bonds4

About 1-(3-piperidin-1-ylbutyl)indazol-3-amine

1-(3-piperidin-1-ylbutyl)indazol-3-amine (PubChem CID 3021373) has the molecular formula C16H24N4 and a molecular weight of 272.40 g/mol. Its IUPAC name is 1-(3-piperidin-1-ylbutyl)indazol-3-amine.

Molecular Properties

Compound Name1-(3-piperidin-1-ylbutyl)indazol-3-amine
PubChem CID3021373
Molecular FormulaC16H24N4
Molecular Weight272.40 g/mol
Exact Mass272.20
IUPAC Name1-(3-piperidin-1-ylbutyl)indazol-3-amine
SMILESCC(CCn1nc(N)c2ccccc21)N1CCCCC1
InChIInChI=1S/C16H24N4/c1-13(19-10-5-2-6-11-19)9-12-20-15-8-4-3-7-14(15)16(17)18-20/h3-4,7-8,13H,2,5-6,9-12H2,1H3,(H2,17,18)
InChIKeyHBRMYSQKTBVBHF-UHFFFAOYSA-N
XLogP2.88
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.40
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(3-piperidin-1-ylbutyl)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 1-(3-piperidin-1-ylbutyl)indazol-3-amine?
The IUPAC name of 1-(3-piperidin-1-ylbutyl)indazol-3-amine (CID 3021373) is 1-(3-piperidin-1-ylbutyl)indazol-3-amine.
What is the SMILES notation for 1-(3-piperidin-1-ylbutyl)indazol-3-amine?
The canonical SMILES for 1-(3-piperidin-1-ylbutyl)indazol-3-amine is CC(CCn1nc(N)c2ccccc21)N1CCCCC1.
What is the InChIKey of 1-(3-piperidin-1-ylbutyl)indazol-3-amine?
The InChIKey is HBRMYSQKTBVBHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4/c1-13(19-10-5-2-6-11-19)9-12-20-15-8-4-3-7-14(15)16(17)18-20/h3-4,7-8,13H,2,5-6,9-12H2,1H3,(H2,17,18).
What are the key properties of 1-(3-piperidin-1-ylbutyl)indazol-3-amine?
1-(3-piperidin-1-ylbutyl)indazol-3-amine has a molecular weight of 272.40 g/mol, XLogP of 2.88, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-piperidin-1-ylbutyl)indazol-3-amine is sourced from PubChem (CID 3021373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).