N-[2-[[5-(1-methoxyethyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxoethyl]benzamide

C14H16N4O3S — CID 134706263

IUPACN-[2-[[5-(1-methoxyethyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxoethyl]benzamide
SMILESCOC(C)c1nnc(NC(=O)CNC(=O)c2ccccc2)s1
InChIInChI=1S/C14H16N4O3S/c1-9(21-2)13-17-18-14(22-13)16-11(19)8-15-12(20)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3,(H,15,20)(H,16,18,19)
InChIKeyMFDOLGCZNKGQOV-UHFFFAOYSA-N
MW320.37 g/mol
LogP1.61
Rot. Bonds6

About N-[2-[[5-(1-methoxyethyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxoethyl]benzamide

N-[2-[[5-(1-methoxyethyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxoethyl]benzamide (PubChem CID 134706263) has the molecular formula C14H16N4O3S and a molecular weight of 320.37 g/mol. Its IUPAC name is N-[2-[[5-(1-methoxyethyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxoethyl]benzamide.

Molecular Properties

Compound NameN-[2-[[5-(1-methoxyethyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxoethyl]benzamide
PubChem CID134706263
Molecular FormulaC14H16N4O3S
Molecular Weight320.37 g/mol
Exact Mass320.09
IUPAC NameN-[2-[[5-(1-methoxyethyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxoethyl]benzamide
SMILESCOC(C)c1nnc(NC(=O)CNC(=O)c2ccccc2)s1
InChIInChI=1S/C14H16N4O3S/c1-9(21-2)13-17-18-14(22-13)16-11(19)8-15-12(20)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3,(H,15,20)(H,16,18,19)
InChIKeyMFDOLGCZNKGQOV-UHFFFAOYSA-N
XLogP1.61
TPSA93.21 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.37
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-[2-[[5-(1-methoxyethyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxoethyl]benzamide 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-[2-oxo-2-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]ethyl]benzamide
CID 19256575
N-[5-(1-methoxyethyl)-1,3,4-thiadiazol-2-yl]-2-[(2-methylphenyl)methylsulfanyl]acetamide
CID 134706786
N-[3-oxo-3-[(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)amino]propyl]benzamide
CID 17154580
N-[2-[[5-(difluoromethyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxoethyl]-3,4-dimethoxybenzamide
CID 47076940
N-[2-oxo-2-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]ethyl]-4-phenylbenzamide
CID 55438240
N-[5-(1-methoxyethyl)-1,3,4-thiadiazol-2-yl]-4-pyrazol-1-ylbenzamide
CID 134697182
N-[4-oxo-4-[(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)amino]butan-2-yl]benzamide
CID 24668127
N-[5-(1-methoxyethyl)-1,3,4-thiadiazol-2-yl]-2-(4-oxoquinazolin-3-yl)acetamide
CID 134711049
N-[5-(1-phenylpropyl)-1,3,4-thiadiazol-2-yl]benzamide
CID 71946235
3-(methanesulfonamido)-N-[5-(1-methoxyethyl)-1,3,4-thiadiazol-2-yl]propanamide
CID 134707819
4-fluoro-N-[2-[[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxoethyl]benzamide
CID 51138217
N-[5-(1-methoxyethyl)-1,3,4-thiadiazol-2-yl]-2-(1,1,2,2-tetrafluoroethoxy)benzamide
CID 134705610

Frequently Asked Questions

What is the IUPAC name of N-[2-[[5-(1-methoxyethyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxoethyl]benzamide?
The IUPAC name of N-[2-[[5-(1-methoxyethyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxoethyl]benzamide (CID 134706263) is N-[2-[[5-(1-methoxyethyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxoethyl]benzamide.
What is the SMILES notation for N-[2-[[5-(1-methoxyethyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxoethyl]benzamide?
The canonical SMILES for N-[2-[[5-(1-methoxyethyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxoethyl]benzamide is COC(C)c1nnc(NC(=O)CNC(=O)c2ccccc2)s1.
What is the InChIKey of N-[2-[[5-(1-methoxyethyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxoethyl]benzamide?
The InChIKey is MFDOLGCZNKGQOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O3S/c1-9(21-2)13-17-18-14(22-13)16-11(19)8-15-12(20)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3,(H,15,20)(H,16,18,19).
What are the key properties of N-[2-[[5-(1-methoxyethyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxoethyl]benzamide?
N-[2-[[5-(1-methoxyethyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxoethyl]benzamide has a molecular weight of 320.37 g/mol, XLogP of 1.61, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[[5-(1-methoxyethyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxoethyl]benzamide is sourced from PubChem (CID 134706263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).