N-cyclobutyl-N-methyl-3-propan-2-yl-1,2,4-thiadiazol-5-amine

C10H17N3S — CID 71861336

IUPACN-cyclobutyl-N-methyl-3-propan-2-yl-1,2,4-thiadiazol-5-amine
SMILESCC(C)c1nsc(N(C)C2CCC2)n1
InChIInChI=1S/C10H17N3S/c1-7(2)9-11-10(14-12-9)13(3)8-5-4-6-8/h7-8H,4-6H2,1-3H3
InChIKeyQZANITLCBIUVQA-UHFFFAOYSA-N
MW211.33 g/mol
LogP2.65
Rot. Bonds3

About N-cyclobutyl-N-methyl-3-propan-2-yl-1,2,4-thiadiazol-5-amine

N-cyclobutyl-N-methyl-3-propan-2-yl-1,2,4-thiadiazol-5-amine (PubChem CID 71861336) has the molecular formula C10H17N3S and a molecular weight of 211.33 g/mol. Its IUPAC name is N-cyclobutyl-N-methyl-3-propan-2-yl-1,2,4-thiadiazol-5-amine.

Molecular Properties

Compound NameN-cyclobutyl-N-methyl-3-propan-2-yl-1,2,4-thiadiazol-5-amine
PubChem CID71861336
Molecular FormulaC10H17N3S
Molecular Weight211.33 g/mol
Exact Mass211.11
IUPAC NameN-cyclobutyl-N-methyl-3-propan-2-yl-1,2,4-thiadiazol-5-amine
SMILESCC(C)c1nsc(N(C)C2CCC2)n1
InChIInChI=1S/C10H17N3S/c1-7(2)9-11-10(14-12-9)13(3)8-5-4-6-8/h7-8H,4-6H2,1-3H3
InChIKeyQZANITLCBIUVQA-UHFFFAOYSA-N
XLogP2.65
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 52.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-cyclobutyl-N-methyl-3-propan-2-yl-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

Frequently Asked Questions

What is the IUPAC name of N-cyclobutyl-N-methyl-3-propan-2-yl-1,2,4-thiadiazol-5-amine?
The IUPAC name of N-cyclobutyl-N-methyl-3-propan-2-yl-1,2,4-thiadiazol-5-amine (CID 71861336) is N-cyclobutyl-N-methyl-3-propan-2-yl-1,2,4-thiadiazol-5-amine.
What is the SMILES notation for N-cyclobutyl-N-methyl-3-propan-2-yl-1,2,4-thiadiazol-5-amine?
The canonical SMILES for N-cyclobutyl-N-methyl-3-propan-2-yl-1,2,4-thiadiazol-5-amine is CC(C)c1nsc(N(C)C2CCC2)n1.
What is the InChIKey of N-cyclobutyl-N-methyl-3-propan-2-yl-1,2,4-thiadiazol-5-amine?
The InChIKey is QZANITLCBIUVQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3S/c1-7(2)9-11-10(14-12-9)13(3)8-5-4-6-8/h7-8H,4-6H2,1-3H3.
What are the key properties of N-cyclobutyl-N-methyl-3-propan-2-yl-1,2,4-thiadiazol-5-amine?
N-cyclobutyl-N-methyl-3-propan-2-yl-1,2,4-thiadiazol-5-amine has a molecular weight of 211.33 g/mol, XLogP of 2.65, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclobutyl-N-methyl-3-propan-2-yl-1,2,4-thiadiazol-5-amine is sourced from PubChem (CID 71861336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).