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

C10H16N4O2S2 — CID 47077048

IUPACN,N-dimethyl-2-[(5-morpholin-4-yl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide
SMILESCN(C)C(=O)CSc1nnc(N2CCOCC2)s1
InChIInChI=1S/C10H16N4O2S2/c1-13(2)8(15)7-17-10-12-11-9(18-10)14-3-5-16-6-4-14/h3-7H2,1-2H3
InChIKeyWASWUHGXBNGRMA-UHFFFAOYSA-N
MW288.40 g/mol
LogP0.56
Rot. Bonds4

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

N,N-dimethyl-2-[(5-morpholin-4-yl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide (PubChem CID 47077048) has the molecular formula C10H16N4O2S2 and a molecular weight of 288.40 g/mol. Its IUPAC name is N,N-dimethyl-2-[(5-morpholin-4-yl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[(5-morpholin-4-yl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide
PubChem CID47077048
Molecular FormulaC10H16N4O2S2
Molecular Weight288.40 g/mol
Exact Mass288.07
IUPAC NameN,N-dimethyl-2-[(5-morpholin-4-yl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide
SMILESCN(C)C(=O)CSc1nnc(N2CCOCC2)s1
InChIInChI=1S/C10H16N4O2S2/c1-13(2)8(15)7-17-10-12-11-9(18-10)14-3-5-16-6-4-14/h3-7H2,1-2H3
InChIKeyWASWUHGXBNGRMA-UHFFFAOYSA-N
XLogP0.56
TPSA58.56 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.40
LogP ≤ 50.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[(5-morpholin-4-yl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide?
The IUPAC name of N,N-dimethyl-2-[(5-morpholin-4-yl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide (CID 47077048) is N,N-dimethyl-2-[(5-morpholin-4-yl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide.
What is the SMILES notation for N,N-dimethyl-2-[(5-morpholin-4-yl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide?
The canonical SMILES for N,N-dimethyl-2-[(5-morpholin-4-yl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide is CN(C)C(=O)CSc1nnc(N2CCOCC2)s1.
What is the InChIKey of N,N-dimethyl-2-[(5-morpholin-4-yl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide?
The InChIKey is WASWUHGXBNGRMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O2S2/c1-13(2)8(15)7-17-10-12-11-9(18-10)14-3-5-16-6-4-14/h3-7H2,1-2H3.
What are the key properties of N,N-dimethyl-2-[(5-morpholin-4-yl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide?
N,N-dimethyl-2-[(5-morpholin-4-yl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide has a molecular weight of 288.40 g/mol, XLogP of 0.56, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[(5-morpholin-4-yl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide is sourced from PubChem (CID 47077048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).