2-amino-2-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)propanamide;hydrochloride

C7H13ClN4OS — CID 119265894

IUPAC2-amino-2-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)propanamide;hydrochloride
SMILESCc1nnc(NC(=O)C(C)(C)N)s1.Cl
InChIInChI=1S/C7H12N4OS.ClH/c1-4-10-11-6(13-4)9-5(12)7(2,3)8;/h8H2,1-3H3,(H,9,11,12);1H
InChIKeyPUCAVQRVKPHGAS-UHFFFAOYSA-N
MW236.73 g/mol
LogP0.94
Rot. Bonds2

About 2-amino-2-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)propanamide;hydrochloride

2-amino-2-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)propanamide;hydrochloride (PubChem CID 119265894) has the molecular formula C7H13ClN4OS and a molecular weight of 236.73 g/mol. Its IUPAC name is 2-amino-2-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)propanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-2-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)propanamide;hydrochloride
PubChem CID119265894
Molecular FormulaC7H13ClN4OS
Molecular Weight236.73 g/mol
Exact Mass236.05
IUPAC Name2-amino-2-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)propanamide;hydrochloride
SMILESCc1nnc(NC(=O)C(C)(C)N)s1.Cl
InChIInChI=1S/C7H12N4OS.ClH/c1-4-10-11-6(13-4)9-5(12)7(2,3)8;/h8H2,1-3H3,(H,9,11,12);1H
InChIKeyPUCAVQRVKPHGAS-UHFFFAOYSA-N
XLogP0.94
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.73
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-2-methyl-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]propanamide;hydrochloride
CID 119279554
2-amino-2-methyl-N-(5-propyl-1,3,4-thiadiazol-2-yl)propanamide;hydrochloride
CID 119270517
2-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-phenylpropanamide
CID 47099211
2,2,3,3,4,4,5,5,5-nonafluoro-N-(5-methyl-1,3,4-thiadiazol-2-yl)pentanamide
CID 4207224
2-amino-2-methyl-N-(thiatriazol-5-yl)propanamide
CID 114912485
4-tert-butyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide
CID 741024
4-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide
CID 676913
2-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-methylpropanamide;hydrochloride
CID 119295888
N-(5-methyl-1,3,4-thiadiazol-2-yl)propanamide;molecular hydrogen
CID 162747394
1-ethyl-3-(5-methyl-1,3,4-thiadiazol-2-yl)urea
CID 21417198
dimethyl-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]azanium
CID 6965716
N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 115624585

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)propanamide;hydrochloride?
The IUPAC name of 2-amino-2-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)propanamide;hydrochloride (CID 119265894) is 2-amino-2-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)propanamide;hydrochloride.
What is the SMILES notation for 2-amino-2-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)propanamide;hydrochloride?
The canonical SMILES for 2-amino-2-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)propanamide;hydrochloride is Cc1nnc(NC(=O)C(C)(C)N)s1.Cl.
What is the InChIKey of 2-amino-2-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)propanamide;hydrochloride?
The InChIKey is PUCAVQRVKPHGAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N4OS.ClH/c1-4-10-11-6(13-4)9-5(12)7(2,3)8;/h8H2,1-3H3,(H,9,11,12);1H.
What are the key properties of 2-amino-2-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)propanamide;hydrochloride?
2-amino-2-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)propanamide;hydrochloride has a molecular weight of 236.73 g/mol, XLogP of 0.94, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)propanamide;hydrochloride is sourced from PubChem (CID 119265894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).