3-cyclopropyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,2,4-thiadiazol-5-amine

C10H12N4S2 — CID 65277152

IUPAC3-cyclopropyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,2,4-thiadiazol-5-amine
SMILESCc1nc(CNc2nc(C3CC3)ns2)cs1
InChIInChI=1S/C10H12N4S2/c1-6-12-8(5-15-6)4-11-10-13-9(14-16-10)7-2-3-7/h5,7H,2-4H2,1H3,(H,11,13,14)
InChIKeyBLAIDSGMMFQREV-UHFFFAOYSA-N
MW252.37 g/mol
LogP2.79
Rot. Bonds4

About 3-cyclopropyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,2,4-thiadiazol-5-amine

3-cyclopropyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,2,4-thiadiazol-5-amine (PubChem CID 65277152) has the molecular formula C10H12N4S2 and a molecular weight of 252.37 g/mol. Its IUPAC name is 3-cyclopropyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,2,4-thiadiazol-5-amine.

Molecular Properties

Compound Name3-cyclopropyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,2,4-thiadiazol-5-amine
PubChem CID65277152
Molecular FormulaC10H12N4S2
Molecular Weight252.37 g/mol
Exact Mass252.05
IUPAC Name3-cyclopropyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,2,4-thiadiazol-5-amine
SMILESCc1nc(CNc2nc(C3CC3)ns2)cs1
InChIInChI=1S/C10H12N4S2/c1-6-12-8(5-15-6)4-11-10-13-9(14-16-10)7-2-3-7/h5,7H,2-4H2,1H3,(H,11,13,14)
InChIKeyBLAIDSGMMFQREV-UHFFFAOYSA-N
XLogP2.79
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.37
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 3-cyclopropyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,2,4-thiadiazol-5-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-cyclopropyl-N-[[2-(2-phenylethyl)-1,3-thiazol-4-yl]methyl]-1,2,4-thiadiazol-5-amine
CID 133429570
3-cyclopropyl-N-(1,3-thiazol-4-ylmethyl)-1,2,4-thiadiazol-5-amine
CID 65274563
2-cyclopropyl-6-hydrazinyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrimidin-4-amine
CID 80964428
3-cyclopropyl-N-(1,3-thiazol-5-ylmethyl)-1,2,4-thiadiazol-5-amine
CID 104577421
1-N-(3-cyclopropyl-1,2,4-thiadiazol-5-yl)propane-1,2-diamine
CID 65275684
3-cyclopropyl-N-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-amine
CID 65271488
3-cyclopropyl-N-[(1-methylpyrazol-4-yl)methyl]-1,2,4-thiadiazol-5-amine
CID 65276713
1-N-(3-cyclopropyl-1,2,4-thiadiazol-5-yl)-2-methylpropane-1,2-diamine
CID 115303698
3-cyclopropyl-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1,2,4-thiadiazol-5-amine
CID 133358213
1-(4-cyclopropylphenyl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]methanamine
CID 79978863
N-methyl-1-(2-methyl-1,3-thiazol-4-yl)methanamine;hydrate;dihydrochloride
CID 74892089
N-tert-butyl-3-cyclopropyl-1,2,4-thiadiazol-5-amine
CID 65268446

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,2,4-thiadiazol-5-amine?
The IUPAC name of 3-cyclopropyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,2,4-thiadiazol-5-amine (CID 65277152) is 3-cyclopropyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,2,4-thiadiazol-5-amine.
What is the SMILES notation for 3-cyclopropyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,2,4-thiadiazol-5-amine?
The canonical SMILES for 3-cyclopropyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,2,4-thiadiazol-5-amine is Cc1nc(CNc2nc(C3CC3)ns2)cs1.
What is the InChIKey of 3-cyclopropyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,2,4-thiadiazol-5-amine?
The InChIKey is BLAIDSGMMFQREV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4S2/c1-6-12-8(5-15-6)4-11-10-13-9(14-16-10)7-2-3-7/h5,7H,2-4H2,1H3,(H,11,13,14).
What are the key properties of 3-cyclopropyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,2,4-thiadiazol-5-amine?
3-cyclopropyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,2,4-thiadiazol-5-amine has a molecular weight of 252.37 g/mol, XLogP of 2.79, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,2,4-thiadiazol-5-amine is sourced from PubChem (CID 65277152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).