(2R)-2-methylsulfanyl-N-(thiadiazol-5-yl)propanamide

C6H9N3OS2 — CID 99794343

IUPAC(2R)-2-methylsulfanyl-N-(thiadiazol-5-yl)propanamide
SMILESCS[C@H](C)C(=O)Nc1cnns1
InChIInChI=1S/C6H9N3OS2/c1-4(11-2)6(10)8-5-3-7-9-12-5/h3-4H,1-2H3,(H,8,10)/t4-/m1/s1
InChIKeyUFUWCUDHXHYXGN-SCSAIBSYSA-N
MW203.29 g/mol
LogP1.23
Rot. Bonds3

About (2R)-2-methylsulfanyl-N-(thiadiazol-5-yl)propanamide

(2R)-2-methylsulfanyl-N-(thiadiazol-5-yl)propanamide (PubChem CID 99794343) has the molecular formula C6H9N3OS2 and a molecular weight of 203.29 g/mol. Its IUPAC name is (2R)-2-methylsulfanyl-N-(thiadiazol-5-yl)propanamide.

Molecular Properties

Compound Name(2R)-2-methylsulfanyl-N-(thiadiazol-5-yl)propanamide
PubChem CID99794343
Molecular FormulaC6H9N3OS2
Molecular Weight203.29 g/mol
Exact Mass203.02
IUPAC Name(2R)-2-methylsulfanyl-N-(thiadiazol-5-yl)propanamide
SMILESCS[C@H](C)C(=O)Nc1cnns1
InChIInChI=1S/C6H9N3OS2/c1-4(11-2)6(10)8-5-3-7-9-12-5/h3-4H,1-2H3,(H,8,10)/t4-/m1/s1
InChIKeyUFUWCUDHXHYXGN-SCSAIBSYSA-N
XLogP1.23
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.29
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-3-methyl-N-(thiadiazol-5-yl)butanamide
CID 130171145
2-ethoxy-N-(thiadiazol-5-yl)propanamide
CID 102562411
(2S)-2-amino-N-(thiadiazol-5-yl)butanamide
CID 104982933
6-amino-2-methyl-N-(thiadiazol-5-yl)heptanamide
CID 114912212
2-amino-2-(4-methylphenyl)-N-(thiadiazol-5-yl)acetamide
CID 114172145
1,1-bis(2-methylsulfanylethyl)-3-(thiadiazol-5-yl)urea
CID 118947903
ethyl N-(thiadiazol-5-yl)carbamate
CID 12707508
2-bromo-2,2-difluoro-N-(thiadiazol-5-yl)acetamide
CID 127011997
2,2-dimethyl-N-(thiadiazol-5-yl)cyclopropane-1-carboxamide
CID 130977857
6-amino-4-ethyl-N-(thiadiazol-5-yl)hexanamide
CID 114912286
4-hydroxy-N-(thiadiazol-5-yl)benzamide
CID 114912827
2-(methylamino)-6-propan-2-yl-N-(thiadiazol-5-yl)pyridine-4-carboxamide
CID 114914188

Frequently Asked Questions

What is the IUPAC name of (2R)-2-methylsulfanyl-N-(thiadiazol-5-yl)propanamide?
The IUPAC name of (2R)-2-methylsulfanyl-N-(thiadiazol-5-yl)propanamide (CID 99794343) is (2R)-2-methylsulfanyl-N-(thiadiazol-5-yl)propanamide.
What is the SMILES notation for (2R)-2-methylsulfanyl-N-(thiadiazol-5-yl)propanamide?
The canonical SMILES for (2R)-2-methylsulfanyl-N-(thiadiazol-5-yl)propanamide is CS[C@H](C)C(=O)Nc1cnns1.
What is the InChIKey of (2R)-2-methylsulfanyl-N-(thiadiazol-5-yl)propanamide?
The InChIKey is UFUWCUDHXHYXGN-SCSAIBSYSA-N. The full InChI is InChI=1S/C6H9N3OS2/c1-4(11-2)6(10)8-5-3-7-9-12-5/h3-4H,1-2H3,(H,8,10)/t4-/m1/s1.
What are the key properties of (2R)-2-methylsulfanyl-N-(thiadiazol-5-yl)propanamide?
(2R)-2-methylsulfanyl-N-(thiadiazol-5-yl)propanamide has a molecular weight of 203.29 g/mol, XLogP of 1.23, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-methylsulfanyl-N-(thiadiazol-5-yl)propanamide is sourced from PubChem (CID 99794343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).