N,N-dipropyl-2-(1,3,4-thiadiazol-2-yl)acetamide

C10H17N3OS — CID 54181109

IUPACN,N-dipropyl-2-(1,3,4-thiadiazol-2-yl)acetamide
SMILESCCCN(CCC)C(=O)Cc1nncs1
InChIInChI=1S/C10H17N3OS/c1-3-5-13(6-4-2)10(14)7-9-12-11-8-15-9/h8H,3-7H2,1-2H3
InChIKeyHJVKFBFQFGUAHR-UHFFFAOYSA-N
MW227.33 g/mol
LogP1.73
Rot. Bonds6

About N,N-dipropyl-2-(1,3,4-thiadiazol-2-yl)acetamide

N,N-dipropyl-2-(1,3,4-thiadiazol-2-yl)acetamide (PubChem CID 54181109) has the molecular formula C10H17N3OS and a molecular weight of 227.33 g/mol. Its IUPAC name is N,N-dipropyl-2-(1,3,4-thiadiazol-2-yl)acetamide.

Molecular Properties

Compound NameN,N-dipropyl-2-(1,3,4-thiadiazol-2-yl)acetamide
PubChem CID54181109
Molecular FormulaC10H17N3OS
Molecular Weight227.33 g/mol
Exact Mass227.11
IUPAC NameN,N-dipropyl-2-(1,3,4-thiadiazol-2-yl)acetamide
SMILESCCCN(CCC)C(=O)Cc1nncs1
InChIInChI=1S/C10H17N3OS/c1-3-5-13(6-4-2)10(14)7-9-12-11-8-15-9/h8H,3-7H2,1-2H3
InChIKeyHJVKFBFQFGUAHR-UHFFFAOYSA-N
XLogP1.73
TPSA46.09 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.33
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N,N-dipropyl-2-(1,3,4-thiadiazol-2-yl)acetamide 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 N,N-dipropyl-2-(1,3,4-thiadiazol-2-yl)acetamide?
The IUPAC name of N,N-dipropyl-2-(1,3,4-thiadiazol-2-yl)acetamide (CID 54181109) is N,N-dipropyl-2-(1,3,4-thiadiazol-2-yl)acetamide.
What is the SMILES notation for N,N-dipropyl-2-(1,3,4-thiadiazol-2-yl)acetamide?
The canonical SMILES for N,N-dipropyl-2-(1,3,4-thiadiazol-2-yl)acetamide is CCCN(CCC)C(=O)Cc1nncs1.
What is the InChIKey of N,N-dipropyl-2-(1,3,4-thiadiazol-2-yl)acetamide?
The InChIKey is HJVKFBFQFGUAHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3OS/c1-3-5-13(6-4-2)10(14)7-9-12-11-8-15-9/h8H,3-7H2,1-2H3.
What are the key properties of N,N-dipropyl-2-(1,3,4-thiadiazol-2-yl)acetamide?
N,N-dipropyl-2-(1,3,4-thiadiazol-2-yl)acetamide has a molecular weight of 227.33 g/mol, XLogP of 1.73, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dipropyl-2-(1,3,4-thiadiazol-2-yl)acetamide is sourced from PubChem (CID 54181109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).