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

C11H14N4OS — CID 103946697

IUPAC3-cyclopropyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1,2,4-thiadiazol-5-amine
SMILESCc1cnc(C(C)Nc2nc(C3CC3)ns2)o1
InChIInChI=1S/C11H14N4OS/c1-6-5-12-10(16-6)7(2)13-11-14-9(15-17-11)8-3-4-8/h5,7-8H,3-4H2,1-2H3,(H,13,14,15)
InChIKeyWKUKOTKAYSFWQB-UHFFFAOYSA-N
MW250.33 g/mol
LogP2.89
Rot. Bonds4

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

3-cyclopropyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1,2,4-thiadiazol-5-amine (PubChem CID 103946697) has the molecular formula C11H14N4OS and a molecular weight of 250.33 g/mol. Its IUPAC name is 3-cyclopropyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1,2,4-thiadiazol-5-amine.

Molecular Properties

Compound Name3-cyclopropyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1,2,4-thiadiazol-5-amine
PubChem CID103946697
Molecular FormulaC11H14N4OS
Molecular Weight250.33 g/mol
Exact Mass250.09
IUPAC Name3-cyclopropyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1,2,4-thiadiazol-5-amine
SMILESCc1cnc(C(C)Nc2nc(C3CC3)ns2)o1
InChIInChI=1S/C11H14N4OS/c1-6-5-12-10(16-6)7(2)13-11-14-9(15-17-11)8-3-4-8/h5,7-8H,3-4H2,1-2H3,(H,13,14,15)
InChIKeyWKUKOTKAYSFWQB-UHFFFAOYSA-N
XLogP2.89
TPSA63.84 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.33
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 3-cyclopropyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-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-[1-(1H-1,2,4-triazol-5-yl)ethyl]-1,2,4-thiadiazol-5-amine
CID 103943106
3-cyclopropyl-N-(3-methylbutan-2-yl)-1,2,4-thiadiazol-5-amine
CID 65271665
3-cyclobutyl-N-propan-2-yl-1,2,4-thiadiazol-5-amine
CID 65268424
N-[1-(5-chlorothiophen-2-yl)ethyl]-3-cyclopropyl-1,2,4-thiadiazol-5-amine
CID 65277160
3-cycloheptyl-N-propan-2-yl-1,2,4-thiadiazol-5-amine
CID 65423064
3-cyclopropyl-N-(1-naphthalen-2-ylethyl)-1,2,4-thiadiazol-5-amine
CID 133352605
3-cyclopropyl-N-[1-[4-(trifluoromethyl)phenyl]ethyl]-1,2,4-thiadiazol-5-amine
CID 133335502
N-[1-(3-chlorophenyl)ethyl]-3-cyclopropyl-1,2,4-thiadiazol-5-amine
CID 65271478
3-cyclopropyl-N-(5-methylhexan-2-yl)-1,2,4-thiadiazol-5-amine
CID 65274507
(2S)-2-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)amino]-3-methylbutan-1-ol
CID 79245937
2-[(3-cyclopropyl-1,2,4-thiadiazol-5-yl)amino]-N,3-dimethylbutanamide
CID 133394625
3-cyclopropyl-N-(2-methyl-1-phenylpropyl)-1,2,4-thiadiazol-5-amine
CID 133358780

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1,2,4-thiadiazol-5-amine?
The IUPAC name of 3-cyclopropyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1,2,4-thiadiazol-5-amine (CID 103946697) is 3-cyclopropyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1,2,4-thiadiazol-5-amine.
What is the SMILES notation for 3-cyclopropyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1,2,4-thiadiazol-5-amine?
The canonical SMILES for 3-cyclopropyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1,2,4-thiadiazol-5-amine is Cc1cnc(C(C)Nc2nc(C3CC3)ns2)o1.
What is the InChIKey of 3-cyclopropyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1,2,4-thiadiazol-5-amine?
The InChIKey is WKUKOTKAYSFWQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4OS/c1-6-5-12-10(16-6)7(2)13-11-14-9(15-17-11)8-3-4-8/h5,7-8H,3-4H2,1-2H3,(H,13,14,15).
What are the key properties of 3-cyclopropyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1,2,4-thiadiazol-5-amine?
3-cyclopropyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1,2,4-thiadiazol-5-amine has a molecular weight of 250.33 g/mol, XLogP of 2.89, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1,2,4-thiadiazol-5-amine is sourced from PubChem (CID 103946697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).