5-[4-(1,2,4-thiadiazol-5-yl)piperazin-1-yl]pentan-1-amine

C11H21N5S — CID 65270133

IUPAC5-[4-(1,2,4-thiadiazol-5-yl)piperazin-1-yl]pentan-1-amine
SMILESNCCCCCN1CCN(c2ncns2)CC1
InChIInChI=1S/C11H21N5S/c12-4-2-1-3-5-15-6-8-16(9-7-15)11-13-10-14-17-11/h10H,1-9,12H2
InChIKeyHUVWIGLNOMDDCI-UHFFFAOYSA-N
MW255.39 g/mol
LogP0.79
Rot. Bonds6

About 5-[4-(1,2,4-thiadiazol-5-yl)piperazin-1-yl]pentan-1-amine

5-[4-(1,2,4-thiadiazol-5-yl)piperazin-1-yl]pentan-1-amine (PubChem CID 65270133) has the molecular formula C11H21N5S and a molecular weight of 255.39 g/mol. Its IUPAC name is 5-[4-(1,2,4-thiadiazol-5-yl)piperazin-1-yl]pentan-1-amine.

Molecular Properties

Compound Name5-[4-(1,2,4-thiadiazol-5-yl)piperazin-1-yl]pentan-1-amine
PubChem CID65270133
Molecular FormulaC11H21N5S
Molecular Weight255.39 g/mol
Exact Mass255.15
IUPAC Name5-[4-(1,2,4-thiadiazol-5-yl)piperazin-1-yl]pentan-1-amine
SMILESNCCCCCN1CCN(c2ncns2)CC1
InChIInChI=1S/C11H21N5S/c12-4-2-1-3-5-15-6-8-16(9-7-15)11-13-10-14-17-11/h10H,1-9,12H2
InChIKeyHUVWIGLNOMDDCI-UHFFFAOYSA-N
XLogP0.79
TPSA58.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.39
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 5-[4-(1,2,4-thiadiazol-5-yl)piperazin-1-yl]pentan-1-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 5-[4-(1,2,4-thiadiazol-5-yl)piperazin-1-yl]pentan-1-amine?
The IUPAC name of 5-[4-(1,2,4-thiadiazol-5-yl)piperazin-1-yl]pentan-1-amine (CID 65270133) is 5-[4-(1,2,4-thiadiazol-5-yl)piperazin-1-yl]pentan-1-amine.
What is the SMILES notation for 5-[4-(1,2,4-thiadiazol-5-yl)piperazin-1-yl]pentan-1-amine?
The canonical SMILES for 5-[4-(1,2,4-thiadiazol-5-yl)piperazin-1-yl]pentan-1-amine is NCCCCCN1CCN(c2ncns2)CC1.
What is the InChIKey of 5-[4-(1,2,4-thiadiazol-5-yl)piperazin-1-yl]pentan-1-amine?
The InChIKey is HUVWIGLNOMDDCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N5S/c12-4-2-1-3-5-15-6-8-16(9-7-15)11-13-10-14-17-11/h10H,1-9,12H2.
What are the key properties of 5-[4-(1,2,4-thiadiazol-5-yl)piperazin-1-yl]pentan-1-amine?
5-[4-(1,2,4-thiadiazol-5-yl)piperazin-1-yl]pentan-1-amine has a molecular weight of 255.39 g/mol, XLogP of 0.79, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-(1,2,4-thiadiazol-5-yl)piperazin-1-yl]pentan-1-amine is sourced from PubChem (CID 65270133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).