2-amino-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole-6-carbonitrile

C7H7N3S — CID 90303417

IUPAC2-amino-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole-6-carbonitrile
SMILESN#CC1CCc2nc(N)sc21
InChIInChI=1S/C7H7N3S/c8-3-4-1-2-5-6(4)11-7(9)10-5/h4H,1-2H2,(H2,9,10)
InChIKeyXOCZYLIPROJGMT-UHFFFAOYSA-N
MW165.22 g/mol
LogP1.28
Rot. Bonds

About 2-amino-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole-6-carbonitrile

2-amino-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole-6-carbonitrile (PubChem CID 90303417) has the molecular formula C7H7N3S and a molecular weight of 165.22 g/mol. Its IUPAC name is 2-amino-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole-6-carbonitrile.

Molecular Properties

Compound Name2-amino-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole-6-carbonitrile
PubChem CID90303417
Molecular FormulaC7H7N3S
Molecular Weight165.22 g/mol
Exact Mass165.04
IUPAC Name2-amino-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole-6-carbonitrile
SMILESN#CC1CCc2nc(N)sc21
InChIInChI=1S/C7H7N3S/c8-3-4-1-2-5-6(4)11-7(9)10-5/h4H,1-2H2,(H2,9,10)
InChIKeyXOCZYLIPROJGMT-UHFFFAOYSA-N
XLogP1.28
TPSA62.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.22
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-amino-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole-6-carbonitrile 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 2-amino-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole-6-carbonitrile?
The IUPAC name of 2-amino-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole-6-carbonitrile (CID 90303417) is 2-amino-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole-6-carbonitrile.
What is the SMILES notation for 2-amino-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole-6-carbonitrile?
The canonical SMILES for 2-amino-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole-6-carbonitrile is N#CC1CCc2nc(N)sc21.
What is the InChIKey of 2-amino-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole-6-carbonitrile?
The InChIKey is XOCZYLIPROJGMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3S/c8-3-4-1-2-5-6(4)11-7(9)10-5/h4H,1-2H2,(H2,9,10).
What are the key properties of 2-amino-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole-6-carbonitrile?
2-amino-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole-6-carbonitrile has a molecular weight of 165.22 g/mol, XLogP of 1.28, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole-6-carbonitrile is sourced from PubChem (CID 90303417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).