1-N-(1,2,4-thiadiazol-5-yl)cyclopentane-1,2-diamine

C7H12N4S — CID 65275516

IUPAC1-N-(1,2,4-thiadiazol-5-yl)cyclopentane-1,2-diamine
SMILESNC1CCCC1Nc1ncns1
InChIInChI=1S/C7H12N4S/c8-5-2-1-3-6(5)11-7-9-4-10-12-7/h4-6H,1-3,8H2,(H,9,10,11)
InChIKeyCPGZYFSEBLJCPA-UHFFFAOYSA-N
MW184.27 g/mol
LogP0.83
Rot. Bonds2

About 1-N-(1,2,4-thiadiazol-5-yl)cyclopentane-1,2-diamine

1-N-(1,2,4-thiadiazol-5-yl)cyclopentane-1,2-diamine (PubChem CID 65275516) has the molecular formula C7H12N4S and a molecular weight of 184.27 g/mol. Its IUPAC name is 1-N-(1,2,4-thiadiazol-5-yl)cyclopentane-1,2-diamine.

Molecular Properties

Compound Name1-N-(1,2,4-thiadiazol-5-yl)cyclopentane-1,2-diamine
PubChem CID65275516
Molecular FormulaC7H12N4S
Molecular Weight184.27 g/mol
Exact Mass184.08
IUPAC Name1-N-(1,2,4-thiadiazol-5-yl)cyclopentane-1,2-diamine
SMILESNC1CCCC1Nc1ncns1
InChIInChI=1S/C7H12N4S/c8-5-2-1-3-6(5)11-7-9-4-10-12-7/h4-6H,1-3,8H2,(H,9,10,11)
InChIKeyCPGZYFSEBLJCPA-UHFFFAOYSA-N
XLogP0.83
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.27
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 1-N-(1,2,4-thiadiazol-5-yl)cyclopentane-1,2-diamine 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-N-(1,2,4-thiadiazol-5-yl)cyclopentane-1,2-diamine?
The IUPAC name of 1-N-(1,2,4-thiadiazol-5-yl)cyclopentane-1,2-diamine (CID 65275516) is 1-N-(1,2,4-thiadiazol-5-yl)cyclopentane-1,2-diamine.
What is the SMILES notation for 1-N-(1,2,4-thiadiazol-5-yl)cyclopentane-1,2-diamine?
The canonical SMILES for 1-N-(1,2,4-thiadiazol-5-yl)cyclopentane-1,2-diamine is NC1CCCC1Nc1ncns1.
What is the InChIKey of 1-N-(1,2,4-thiadiazol-5-yl)cyclopentane-1,2-diamine?
The InChIKey is CPGZYFSEBLJCPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N4S/c8-5-2-1-3-6(5)11-7-9-4-10-12-7/h4-6H,1-3,8H2,(H,9,10,11).
What are the key properties of 1-N-(1,2,4-thiadiazol-5-yl)cyclopentane-1,2-diamine?
1-N-(1,2,4-thiadiazol-5-yl)cyclopentane-1,2-diamine has a molecular weight of 184.27 g/mol, XLogP of 0.83, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(1,2,4-thiadiazol-5-yl)cyclopentane-1,2-diamine is sourced from PubChem (CID 65275516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).