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

C9H15N3O2S2 — CID 18076362

IUPACN-(1-methoxypropan-2-yl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide
SMILESCOCC(C)NC(=O)CSc1nnc(C)s1
InChIInChI=1S/C9H15N3O2S2/c1-6(4-14-3)10-8(13)5-15-9-12-11-7(2)16-9/h6H,4-5H2,1-3H3,(H,10,13)
InChIKeyDCIBDEUJPKNAFO-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.09
Rot. Bonds6

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

N-(1-methoxypropan-2-yl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide (PubChem CID 18076362) has the molecular formula C9H15N3O2S2 and a molecular weight of 261.37 g/mol. Its IUPAC name is N-(1-methoxypropan-2-yl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide.

Molecular Properties

Compound NameN-(1-methoxypropan-2-yl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide
PubChem CID18076362
Molecular FormulaC9H15N3O2S2
Molecular Weight261.37 g/mol
Exact Mass261.06
IUPAC NameN-(1-methoxypropan-2-yl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide
SMILESCOCC(C)NC(=O)CSc1nnc(C)s1
InChIInChI=1S/C9H15N3O2S2/c1-6(4-14-3)10-8(13)5-15-9-12-11-7(2)16-9/h6H,4-5H2,1-3H3,(H,10,13)
InChIKeyDCIBDEUJPKNAFO-UHFFFAOYSA-N
XLogP1.09
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(1-methoxypropan-2-yl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-cyclopropyl-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide
CID 2994294
2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-N-propylacetamide
CID 2141536
(2-(5-ME-(1,3,4)Thiadiazol-2-ylsulfanyl)-acetylamino)-acetic acid ethyl ester
CID 2729284
N-(1-methyl-3-morpholin-4-ylpropyl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]acetamide
CID 46983226
N-ethyl-N-(2-methoxyethyl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]acetamide
CID 46991098
N-(2-methoxyethyl)-5-methylsulfanyl-1,3,4-thiadiazole-2-carboxamide
CID 54348711
5-hexylsulfanyl-N-(2-methoxyethyl)-1,3,4-thiadiazole-2-carboxamide
CID 54488197
5-butan-2-ylsulfanyl-N-(2-methoxyethyl)-1,3,4-thiadiazole-2-carboxamide
CID 57315498
N-(2-hydroxyethyl)-2-(5-methyl(1,3,4-thiadiazol-2-ylthio))acetamide
CID 3609076
N-(2-hydroxypropyl)-2-(5-methyl(1,3,4-thiadiazol-2-ylthio))acetamide
CID 4081812
N-(2-hydroxy-isopropyl)-2-(5-methyl(1,3,4-thiadiazol-2-ylthio))acetamide
CID 4668021
2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-N-propan-2-ylacetamide
CID 7474295

Frequently Asked Questions

What is the IUPAC name of N-(1-methoxypropan-2-yl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide?
The IUPAC name of N-(1-methoxypropan-2-yl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide (CID 18076362) is N-(1-methoxypropan-2-yl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide.
What is the SMILES notation for N-(1-methoxypropan-2-yl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide?
The canonical SMILES for N-(1-methoxypropan-2-yl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide is COCC(C)NC(=O)CSc1nnc(C)s1.
What is the InChIKey of N-(1-methoxypropan-2-yl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide?
The InChIKey is DCIBDEUJPKNAFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O2S2/c1-6(4-14-3)10-8(13)5-15-9-12-11-7(2)16-9/h6H,4-5H2,1-3H3,(H,10,13).
What are the key properties of N-(1-methoxypropan-2-yl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide?
N-(1-methoxypropan-2-yl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide has a molecular weight of 261.37 g/mol, XLogP of 1.09, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methoxypropan-2-yl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide is sourced from PubChem (CID 18076362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).