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

C9H15N3S — CID 107648350

IUPAC5-methyl-N-[1-(1-methylcyclopropyl)ethyl]-1,3,4-thiadiazol-2-amine
SMILESCc1nnc(NC(C)C2(C)CC2)s1
InChIInChI=1S/C9H15N3S/c1-6(9(3)4-5-9)10-8-12-11-7(2)13-8/h6H,4-5H2,1-3H3,(H,10,12)
InChIKeyAYZFLCMPOXZARI-UHFFFAOYSA-N
MW197.31 g/mol
LogP2.45
Rot. Bonds3

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

5-methyl-N-[1-(1-methylcyclopropyl)ethyl]-1,3,4-thiadiazol-2-amine (PubChem CID 107648350) has the molecular formula C9H15N3S and a molecular weight of 197.31 g/mol. Its IUPAC name is 5-methyl-N-[1-(1-methylcyclopropyl)ethyl]-1,3,4-thiadiazol-2-amine.

Molecular Properties

Compound Name5-methyl-N-[1-(1-methylcyclopropyl)ethyl]-1,3,4-thiadiazol-2-amine
PubChem CID107648350
Molecular FormulaC9H15N3S
Molecular Weight197.31 g/mol
Exact Mass197.10
IUPAC Name5-methyl-N-[1-(1-methylcyclopropyl)ethyl]-1,3,4-thiadiazol-2-amine
SMILESCc1nnc(NC(C)C2(C)CC2)s1
InChIInChI=1S/C9H15N3S/c1-6(9(3)4-5-9)10-8-12-11-7(2)13-8/h6H,4-5H2,1-3H3,(H,10,12)
InChIKeyAYZFLCMPOXZARI-UHFFFAOYSA-N
XLogP2.45
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.31
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-methyl-N-[1-(1-methylcyclopropyl)ethyl]-1,3,4-thiadiazol-2-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

N-(5-Methyl-1,3,4-thiadiazol-2-YL)-N-neopentylamine
CID 2798093
N-cyclopentyl-5-methyl-1,3,4-thiadiazol-2-amine
CID 676548
N-[(1-ethylcyclopropyl)methyl]-5-(trifluoromethyl)-1,3,4-thiadiazol-2-amine
CID 104924664
N-[(1-propan-2-ylcyclopropyl)methyl]-5-(trifluoromethyl)-1,3,4-thiadiazol-2-amine
CID 104924706
N-[(1-propylcyclopropyl)methyl]-5-(trifluoromethyl)-1,3,4-thiadiazol-2-amine
CID 104924808
N-(3-ethylpentan-2-yl)-5-(trifluoromethyl)-1,3,4-thiadiazol-2-amine
CID 113586979
N-(2,2,3,3-tetramethylcyclopropyl)-5-(trifluoromethyl)-1,3,4-thiadiazol-2-amine
CID 113586985
N-(1-cyclopropylethyl)-5-(trifluoromethyl)-1,3,4-thiadiazol-2-amine
CID 114448200
N-(2,2-dimethylcyclopropyl)-5-(trifluoromethyl)-1,3,4-thiadiazol-2-amine
CID 114448349
N-(3-methylpentan-2-yl)-5-(trifluoromethyl)-1,3,4-thiadiazol-2-amine
CID 114448596
N-(3,3-dimethylbutan-2-yl)-5-(trifluoromethyl)-1,3,4-thiadiazol-2-amine
CID 114449759
N-[[1-(2-aminoethyl)cyclopropyl]methyl]-5-(trifluoromethyl)-1,3,4-thiadiazol-2-amine
CID 114759143

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-[1-(1-methylcyclopropyl)ethyl]-1,3,4-thiadiazol-2-amine?
The IUPAC name of 5-methyl-N-[1-(1-methylcyclopropyl)ethyl]-1,3,4-thiadiazol-2-amine (CID 107648350) is 5-methyl-N-[1-(1-methylcyclopropyl)ethyl]-1,3,4-thiadiazol-2-amine.
What is the SMILES notation for 5-methyl-N-[1-(1-methylcyclopropyl)ethyl]-1,3,4-thiadiazol-2-amine?
The canonical SMILES for 5-methyl-N-[1-(1-methylcyclopropyl)ethyl]-1,3,4-thiadiazol-2-amine is Cc1nnc(NC(C)C2(C)CC2)s1.
What is the InChIKey of 5-methyl-N-[1-(1-methylcyclopropyl)ethyl]-1,3,4-thiadiazol-2-amine?
The InChIKey is AYZFLCMPOXZARI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3S/c1-6(9(3)4-5-9)10-8-12-11-7(2)13-8/h6H,4-5H2,1-3H3,(H,10,12).
What are the key properties of 5-methyl-N-[1-(1-methylcyclopropyl)ethyl]-1,3,4-thiadiazol-2-amine?
5-methyl-N-[1-(1-methylcyclopropyl)ethyl]-1,3,4-thiadiazol-2-amine has a molecular weight of 197.31 g/mol, XLogP of 2.45, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[1-(1-methylcyclopropyl)ethyl]-1,3,4-thiadiazol-2-amine is sourced from PubChem (CID 107648350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).