5-(2,2,3,3-tetramethylcyclopropyl)-1,2,4-thiadiazol-3-amine

C9H15N3S — CID 66478689

IUPAC5-(2,2,3,3-tetramethylcyclopropyl)-1,2,4-thiadiazol-3-amine
SMILESCC1(C)C(c2nc(N)ns2)C1(C)C
InChIInChI=1S/C9H15N3S/c1-8(2)5(9(8,3)4)6-11-7(10)12-13-6/h5H,1-4H3,(H2,10,12)
InChIKeyDKOUZXHNIDVIEZ-UHFFFAOYSA-N
MW197.31 g/mol
LogP2.27
Rot. Bonds1

About 5-(2,2,3,3-tetramethylcyclopropyl)-1,2,4-thiadiazol-3-amine

5-(2,2,3,3-tetramethylcyclopropyl)-1,2,4-thiadiazol-3-amine (PubChem CID 66478689) has the molecular formula C9H15N3S and a molecular weight of 197.31 g/mol. Its IUPAC name is 5-(2,2,3,3-tetramethylcyclopropyl)-1,2,4-thiadiazol-3-amine.

Molecular Properties

Compound Name5-(2,2,3,3-tetramethylcyclopropyl)-1,2,4-thiadiazol-3-amine
PubChem CID66478689
Molecular FormulaC9H15N3S
Molecular Weight197.31 g/mol
Exact Mass197.10
IUPAC Name5-(2,2,3,3-tetramethylcyclopropyl)-1,2,4-thiadiazol-3-amine
SMILESCC1(C)C(c2nc(N)ns2)C1(C)C
InChIInChI=1S/C9H15N3S/c1-8(2)5(9(8,3)4)6-11-7(10)12-13-6/h5H,1-4H3,(H2,10,12)
InChIKeyDKOUZXHNIDVIEZ-UHFFFAOYSA-N
XLogP2.27
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.31
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-(2,2,3,3-tetramethylcyclopropyl)-1,2,4-thiadiazol-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 5-(2,2,3,3-tetramethylcyclopropyl)-1,2,4-thiadiazol-3-amine?
The IUPAC name of 5-(2,2,3,3-tetramethylcyclopropyl)-1,2,4-thiadiazol-3-amine (CID 66478689) is 5-(2,2,3,3-tetramethylcyclopropyl)-1,2,4-thiadiazol-3-amine.
What is the SMILES notation for 5-(2,2,3,3-tetramethylcyclopropyl)-1,2,4-thiadiazol-3-amine?
The canonical SMILES for 5-(2,2,3,3-tetramethylcyclopropyl)-1,2,4-thiadiazol-3-amine is CC1(C)C(c2nc(N)ns2)C1(C)C.
What is the InChIKey of 5-(2,2,3,3-tetramethylcyclopropyl)-1,2,4-thiadiazol-3-amine?
The InChIKey is DKOUZXHNIDVIEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3S/c1-8(2)5(9(8,3)4)6-11-7(10)12-13-6/h5H,1-4H3,(H2,10,12).
What are the key properties of 5-(2,2,3,3-tetramethylcyclopropyl)-1,2,4-thiadiazol-3-amine?
5-(2,2,3,3-tetramethylcyclopropyl)-1,2,4-thiadiazol-3-amine has a molecular weight of 197.31 g/mol, XLogP of 2.27, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,2,3,3-tetramethylcyclopropyl)-1,2,4-thiadiazol-3-amine is sourced from PubChem (CID 66478689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).