(2R)-2-amino-3,3-dimethyl-N-(thiadiazol-5-yl)butanamide

C8H14N4OS — CID 104982918

IUPAC(2R)-2-amino-3,3-dimethyl-N-(thiadiazol-5-yl)butanamide
SMILESCC(C)(C)[C@@H](N)C(=O)Nc1cnns1
InChIInChI=1S/C8H14N4OS/c1-8(2,3)6(9)7(13)11-5-4-10-12-14-5/h4,6H,9H2,1-3H3,(H,11,13)/t6-/m0/s1
InChIKeyXTAQRIQYRWNCLP-LURJTMIESA-N
MW214.29 g/mol
LogP0.85
Rot. Bonds2

About (2R)-2-amino-3,3-dimethyl-N-(thiadiazol-5-yl)butanamide

(2R)-2-amino-3,3-dimethyl-N-(thiadiazol-5-yl)butanamide (PubChem CID 104982918) has the molecular formula C8H14N4OS and a molecular weight of 214.29 g/mol. Its IUPAC name is (2R)-2-amino-3,3-dimethyl-N-(thiadiazol-5-yl)butanamide.

Molecular Properties

Compound Name(2R)-2-amino-3,3-dimethyl-N-(thiadiazol-5-yl)butanamide
PubChem CID104982918
Molecular FormulaC8H14N4OS
Molecular Weight214.29 g/mol
Exact Mass214.09
IUPAC Name(2R)-2-amino-3,3-dimethyl-N-(thiadiazol-5-yl)butanamide
SMILESCC(C)(C)[C@@H](N)C(=O)Nc1cnns1
InChIInChI=1S/C8H14N4OS/c1-8(2,3)6(9)7(13)11-5-4-10-12-14-5/h4,6H,9H2,1-3H3,(H,11,13)/t6-/m0/s1
InChIKeyXTAQRIQYRWNCLP-LURJTMIESA-N
XLogP0.85
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.29
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze (2R)-2-amino-3,3-dimethyl-N-(thiadiazol-5-yl)butanamide 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 (2R)-2-amino-3,3-dimethyl-N-(thiadiazol-5-yl)butanamide?
The IUPAC name of (2R)-2-amino-3,3-dimethyl-N-(thiadiazol-5-yl)butanamide (CID 104982918) is (2R)-2-amino-3,3-dimethyl-N-(thiadiazol-5-yl)butanamide.
What is the SMILES notation for (2R)-2-amino-3,3-dimethyl-N-(thiadiazol-5-yl)butanamide?
The canonical SMILES for (2R)-2-amino-3,3-dimethyl-N-(thiadiazol-5-yl)butanamide is CC(C)(C)[C@@H](N)C(=O)Nc1cnns1.
What is the InChIKey of (2R)-2-amino-3,3-dimethyl-N-(thiadiazol-5-yl)butanamide?
The InChIKey is XTAQRIQYRWNCLP-LURJTMIESA-N. The full InChI is InChI=1S/C8H14N4OS/c1-8(2,3)6(9)7(13)11-5-4-10-12-14-5/h4,6H,9H2,1-3H3,(H,11,13)/t6-/m0/s1.
What are the key properties of (2R)-2-amino-3,3-dimethyl-N-(thiadiazol-5-yl)butanamide?
(2R)-2-amino-3,3-dimethyl-N-(thiadiazol-5-yl)butanamide has a molecular weight of 214.29 g/mol, XLogP of 0.85, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-3,3-dimethyl-N-(thiadiazol-5-yl)butanamide is sourced from PubChem (CID 104982918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).