N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-naphthalen-2-yloxyacetamide

C16H15N3O2S — CID 684783

IUPACN-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-naphthalen-2-yloxyacetamide
SMILESCCc1nnc(NC(=O)COc2ccc3ccccc3c2)s1
InChIInChI=1S/C16H15N3O2S/c1-2-15-18-19-16(22-15)17-14(20)10-21-13-8-7-11-5-3-4-6-12(11)9-13/h3-9H,2,10H2,1H3,(H,17,19,20)
InChIKeyQAZVHYSZQRGANU-UHFFFAOYSA-N
MW313.38 g/mol
LogP3.27
Rot. Bonds5

About N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-naphthalen-2-yloxyacetamide

N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-naphthalen-2-yloxyacetamide (PubChem CID 684783) has the molecular formula C16H15N3O2S and a molecular weight of 313.38 g/mol. Its IUPAC name is N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-naphthalen-2-yloxyacetamide.

Molecular Properties

Compound NameN-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-naphthalen-2-yloxyacetamide
PubChem CID684783
Molecular FormulaC16H15N3O2S
Molecular Weight313.38 g/mol
Exact Mass313.09
IUPAC NameN-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-naphthalen-2-yloxyacetamide
SMILESCCc1nnc(NC(=O)COc2ccc3ccccc3c2)s1
InChIInChI=1S/C16H15N3O2S/c1-2-15-18-19-16(22-15)17-14(20)10-21-13-8-7-11-5-3-4-6-12(11)9-13/h3-9H,2,10H2,1H3,(H,17,19,20)
InChIKeyQAZVHYSZQRGANU-UHFFFAOYSA-N
XLogP3.27
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.38
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-Cyclohexyl-[1,3,4]thiadiazol-2-yl)-2-o-tolyloxy-acetamide
CID 929487
N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-2-(2-methyl-5-propan-2-ylphenoxy)acetamide
CID 3876898
N-{5-[(E)-2-(4-Methoxy-phenyl)-vinyl]-[1,3,4]thiadiazol-2-yl}-2-m-tolyloxy-acetamide
CID 6172639
N-{5-[(E)-2-(4-Methoxy-phenyl)-vinyl]-[1,3,4]thiadiazol-2-yl}-2-p-tolyloxy-acetamide
CID 6230690
N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-2-(4-fluorophenoxy)acetamide
CID 976078
N-[5-(3,4-Dimethoxy-benzyl)-[1,3,4]thiadiazol-2-yl]-2-ethoxy-acetamide
CID 648343
Ethyl 2-[5-[[2-(4-methylphenoxy)acetyl]amino]-1,3,4-thiadiazol-2-yl]acetate
CID 665231
2-methoxy-N-[5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]acetamide
CID 777645
N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-2-(2-naphthyloxy)acetamide
CID 898673
2-naphthalen-2-yloxy-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)acetamide
CID 2092314
2-(2-methylphenoxy)-N-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]acetamide
CID 2203190
N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-2-phenoxypropanamide
CID 2932483

Frequently Asked Questions

What is the IUPAC name of N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-naphthalen-2-yloxyacetamide?
The IUPAC name of N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-naphthalen-2-yloxyacetamide (CID 684783) is N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-naphthalen-2-yloxyacetamide.
What is the SMILES notation for N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-naphthalen-2-yloxyacetamide?
The canonical SMILES for N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-naphthalen-2-yloxyacetamide is CCc1nnc(NC(=O)COc2ccc3ccccc3c2)s1.
What is the InChIKey of N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-naphthalen-2-yloxyacetamide?
The InChIKey is QAZVHYSZQRGANU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O2S/c1-2-15-18-19-16(22-15)17-14(20)10-21-13-8-7-11-5-3-4-6-12(11)9-13/h3-9H,2,10H2,1H3,(H,17,19,20).
What are the key properties of N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-naphthalen-2-yloxyacetamide?
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-naphthalen-2-yloxyacetamide has a molecular weight of 313.38 g/mol, XLogP of 3.27, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-naphthalen-2-yloxyacetamide is sourced from PubChem (CID 684783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).