N,N-dimethyl-2-[(3-propyl-1,2,4-thiadiazol-5-yl)amino]acetamide

C9H16N4OS — CID 65271389

IUPACN,N-dimethyl-2-[(3-propyl-1,2,4-thiadiazol-5-yl)amino]acetamide
SMILESCCCc1nsc(NCC(=O)N(C)C)n1
InChIInChI=1S/C9H16N4OS/c1-4-5-7-11-9(15-12-7)10-6-8(14)13(2)3/h4-6H2,1-3H3,(H,10,11,12)
InChIKeyDAMFYRUNBPPJST-UHFFFAOYSA-N
MW228.32 g/mol
LogP0.99
Rot. Bonds5

About N,N-dimethyl-2-[(3-propyl-1,2,4-thiadiazol-5-yl)amino]acetamide

N,N-dimethyl-2-[(3-propyl-1,2,4-thiadiazol-5-yl)amino]acetamide (PubChem CID 65271389) has the molecular formula C9H16N4OS and a molecular weight of 228.32 g/mol. Its IUPAC name is N,N-dimethyl-2-[(3-propyl-1,2,4-thiadiazol-5-yl)amino]acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[(3-propyl-1,2,4-thiadiazol-5-yl)amino]acetamide
PubChem CID65271389
Molecular FormulaC9H16N4OS
Molecular Weight228.32 g/mol
Exact Mass228.10
IUPAC NameN,N-dimethyl-2-[(3-propyl-1,2,4-thiadiazol-5-yl)amino]acetamide
SMILESCCCc1nsc(NCC(=O)N(C)C)n1
InChIInChI=1S/C9H16N4OS/c1-4-5-7-11-9(15-12-7)10-6-8(14)13(2)3/h4-6H2,1-3H3,(H,10,11,12)
InChIKeyDAMFYRUNBPPJST-UHFFFAOYSA-N
XLogP0.99
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.32
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[(3-propyl-1,2,4-thiadiazol-5-yl)amino]acetamide?
The IUPAC name of N,N-dimethyl-2-[(3-propyl-1,2,4-thiadiazol-5-yl)amino]acetamide (CID 65271389) is N,N-dimethyl-2-[(3-propyl-1,2,4-thiadiazol-5-yl)amino]acetamide.
What is the SMILES notation for N,N-dimethyl-2-[(3-propyl-1,2,4-thiadiazol-5-yl)amino]acetamide?
The canonical SMILES for N,N-dimethyl-2-[(3-propyl-1,2,4-thiadiazol-5-yl)amino]acetamide is CCCc1nsc(NCC(=O)N(C)C)n1.
What is the InChIKey of N,N-dimethyl-2-[(3-propyl-1,2,4-thiadiazol-5-yl)amino]acetamide?
The InChIKey is DAMFYRUNBPPJST-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4OS/c1-4-5-7-11-9(15-12-7)10-6-8(14)13(2)3/h4-6H2,1-3H3,(H,10,11,12).
What are the key properties of N,N-dimethyl-2-[(3-propyl-1,2,4-thiadiazol-5-yl)amino]acetamide?
N,N-dimethyl-2-[(3-propyl-1,2,4-thiadiazol-5-yl)amino]acetamide has a molecular weight of 228.32 g/mol, XLogP of 0.99, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[(3-propyl-1,2,4-thiadiazol-5-yl)amino]acetamide is sourced from PubChem (CID 65271389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).