2-cyclopropylsulfanyl-5-methyl-1,3,4-thiadiazole

C6H8N2S2 — CID 127014892

IUPAC2-cyclopropylsulfanyl-5-methyl-1,3,4-thiadiazole
SMILESCc1nnc(SC2CC2)s1
InChIInChI=1S/C6H8N2S2/c1-4-7-8-6(9-4)10-5-2-3-5/h5H,2-3H2,1H3
InChIKeyRJMJNHYTMGOWTR-UHFFFAOYSA-N
MW172.28 g/mol
LogP2.10
Rot. Bonds2

About 2-cyclopropylsulfanyl-5-methyl-1,3,4-thiadiazole

2-cyclopropylsulfanyl-5-methyl-1,3,4-thiadiazole (PubChem CID 127014892) has the molecular formula C6H8N2S2 and a molecular weight of 172.28 g/mol. Its IUPAC name is 2-cyclopropylsulfanyl-5-methyl-1,3,4-thiadiazole.

Molecular Properties

Compound Name2-cyclopropylsulfanyl-5-methyl-1,3,4-thiadiazole
PubChem CID127014892
Molecular FormulaC6H8N2S2
Molecular Weight172.28 g/mol
Exact Mass172.01
IUPAC Name2-cyclopropylsulfanyl-5-methyl-1,3,4-thiadiazole
SMILESCc1nnc(SC2CC2)s1
InChIInChI=1S/C6H8N2S2/c1-4-7-8-6(9-4)10-5-2-3-5/h5H,2-3H2,1H3
InChIKeyRJMJNHYTMGOWTR-UHFFFAOYSA-N
XLogP2.10
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.28
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-cyclopropylsulfanyl-5-methyl-1,3,4-thiadiazole 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

2-methyl-5-piperidin-4-ylsulfanyl-1,3,4-thiadiazole;hydrochloride
CID 72716088
2-methyl-5-(oxetan-3-ylsulfanyl)-1,3,4-thiadiazole
CID 130621818
2-(3-methoxycyclobutyl)sulfanyl-5-methyl-1,3,4-thiadiazole
CID 131160028
2-cyclopentylsulfanyl-5-methylsulfanyl-1,3,4-thiadiazole
CID 131208793
1-(methylamino)-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]cyclopentane-1-carboxamide
CID 79654481
[1-amino-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]cyclohexyl]methanol
CID 79640365
2-(cyclopropylmethylsulfanyl)-5-methyl-1,3,4-thiadiazole
CID 54026065
[1-(methylamino)-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]cyclohexyl]methanol
CID 79640287
[3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(propylamino)cyclopentyl]methanol
CID 79644289
N,2,2-trimethyl-5-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]cyclopentan-1-amine
CID 79862767
2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]cycloheptane-1-carboxylic acid
CID 63097731
[4-methyl-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]cyclohexyl]methanamine
CID 60876574

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropylsulfanyl-5-methyl-1,3,4-thiadiazole?
The IUPAC name of 2-cyclopropylsulfanyl-5-methyl-1,3,4-thiadiazole (CID 127014892) is 2-cyclopropylsulfanyl-5-methyl-1,3,4-thiadiazole.
What is the SMILES notation for 2-cyclopropylsulfanyl-5-methyl-1,3,4-thiadiazole?
The canonical SMILES for 2-cyclopropylsulfanyl-5-methyl-1,3,4-thiadiazole is Cc1nnc(SC2CC2)s1.
What is the InChIKey of 2-cyclopropylsulfanyl-5-methyl-1,3,4-thiadiazole?
The InChIKey is RJMJNHYTMGOWTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2S2/c1-4-7-8-6(9-4)10-5-2-3-5/h5H,2-3H2,1H3.
What are the key properties of 2-cyclopropylsulfanyl-5-methyl-1,3,4-thiadiazole?
2-cyclopropylsulfanyl-5-methyl-1,3,4-thiadiazole has a molecular weight of 172.28 g/mol, XLogP of 2.10, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropylsulfanyl-5-methyl-1,3,4-thiadiazole is sourced from PubChem (CID 127014892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).