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

C9H17ClN4OS — CID 119270517

IUPAC2-amino-2-methyl-N-(5-propyl-1,3,4-thiadiazol-2-yl)propanamide;hydrochloride
SMILESCCCc1nnc(NC(=O)C(C)(C)N)s1.Cl
InChIInChI=1S/C9H16N4OS.ClH/c1-4-5-6-12-13-8(15-6)11-7(14)9(2,3)10;/h4-5,10H2,1-3H3,(H,11,13,14);1H
InChIKeyRMLZCOMERHDTNY-UHFFFAOYSA-N
MW264.78 g/mol
LogP1.59
Rot. Bonds4

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

2-amino-2-methyl-N-(5-propyl-1,3,4-thiadiazol-2-yl)propanamide;hydrochloride (PubChem CID 119270517) has the molecular formula C9H17ClN4OS and a molecular weight of 264.78 g/mol. Its IUPAC name is 2-amino-2-methyl-N-(5-propyl-1,3,4-thiadiazol-2-yl)propanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-2-methyl-N-(5-propyl-1,3,4-thiadiazol-2-yl)propanamide;hydrochloride
PubChem CID119270517
Molecular FormulaC9H17ClN4OS
Molecular Weight264.78 g/mol
Exact Mass264.08
IUPAC Name2-amino-2-methyl-N-(5-propyl-1,3,4-thiadiazol-2-yl)propanamide;hydrochloride
SMILESCCCc1nnc(NC(=O)C(C)(C)N)s1.Cl
InChIInChI=1S/C9H16N4OS.ClH/c1-4-5-6-12-13-8(15-6)11-7(14)9(2,3)10;/h4-5,10H2,1-3H3,(H,11,13,14);1H
InChIKeyRMLZCOMERHDTNY-UHFFFAOYSA-N
XLogP1.59
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.78
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-chloro-2,2-dimethyl-N-(5-propyl-1,3,4-thiadiazol-2-yl)propanamide
CID 82109868
2-amino-2-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)propanamide;hydrochloride
CID 119265894
2-tert-butylsulfanyl-N-(5-propyl-1,3,4-thiadiazol-2-yl)acetamide
CID 78792540
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2,2-dimethylpropanamide
CID 692810
2,2-dichloro-N-(5-propyl-1,3,4-thiadiazol-2-yl)acetamide
CID 19189341
N-ethyl-N'-(5-propyl-1,3,4-thiadiazol-2-yl)propanediamide
CID 676814
3-hydroxy-N-[5-[4-[5-[[3-hydroxy-2-(hydroxymethyl)-2-methylpropanoyl]amino]-1,3,4-thiadiazol-2-yl]butyl]-1,3,4-thiadiazol-2-yl]-2-(hydroxymethyl)-2-methylpropanamide
CID 74982484
2-amino-2-methyl-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]propanamide;hydrochloride
CID 119279554
1-butyl-3-(5-propyl-1,3,4-thiadiazol-2-yl)urea
CID 47199526
2-amino-N-[5-[(3-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl]-2-methylpropanamide;hydrochloride
CID 119336923
tert-butyl N-[3-oxo-3-[(5-propyl-1,3,4-thiadiazol-2-yl)amino]propyl]carbamate
CID 34111171
N-(5-propyl-1,3,4-thiadiazol-2-yl)benzamide
CID 677143

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-methyl-N-(5-propyl-1,3,4-thiadiazol-2-yl)propanamide;hydrochloride?
The IUPAC name of 2-amino-2-methyl-N-(5-propyl-1,3,4-thiadiazol-2-yl)propanamide;hydrochloride (CID 119270517) is 2-amino-2-methyl-N-(5-propyl-1,3,4-thiadiazol-2-yl)propanamide;hydrochloride.
What is the SMILES notation for 2-amino-2-methyl-N-(5-propyl-1,3,4-thiadiazol-2-yl)propanamide;hydrochloride?
The canonical SMILES for 2-amino-2-methyl-N-(5-propyl-1,3,4-thiadiazol-2-yl)propanamide;hydrochloride is CCCc1nnc(NC(=O)C(C)(C)N)s1.Cl.
What is the InChIKey of 2-amino-2-methyl-N-(5-propyl-1,3,4-thiadiazol-2-yl)propanamide;hydrochloride?
The InChIKey is RMLZCOMERHDTNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4OS.ClH/c1-4-5-6-12-13-8(15-6)11-7(14)9(2,3)10;/h4-5,10H2,1-3H3,(H,11,13,14);1H.
What are the key properties of 2-amino-2-methyl-N-(5-propyl-1,3,4-thiadiazol-2-yl)propanamide;hydrochloride?
2-amino-2-methyl-N-(5-propyl-1,3,4-thiadiazol-2-yl)propanamide;hydrochloride has a molecular weight of 264.78 g/mol, XLogP of 1.59, 4 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-propyl-1,3,4-thiadiazol-2-yl)propanamide;hydrochloride is sourced from PubChem (CID 119270517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).