N-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]thiophene-2-carboxamide

C14H11N3O2S — CID 110725523

IUPACN-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]thiophene-2-carboxamide
SMILESCc1nnc(-c2ccc(NC(=O)c3cccs3)cc2)o1
InChIInChI=1S/C14H11N3O2S/c1-9-16-17-14(19-9)10-4-6-11(7-5-10)15-13(18)12-3-2-8-20-12/h2-8H,1H3,(H,15,18)
InChIKeyJIXRZGZBRIXLIV-UHFFFAOYSA-N
MW285.33 g/mol
LogP3.36
Rot. Bonds3

About N-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]thiophene-2-carboxamide

N-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]thiophene-2-carboxamide (PubChem CID 110725523) has the molecular formula C14H11N3O2S and a molecular weight of 285.33 g/mol. Its IUPAC name is N-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]thiophene-2-carboxamide
PubChem CID110725523
Molecular FormulaC14H11N3O2S
Molecular Weight285.33 g/mol
Exact Mass285.06
IUPAC NameN-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]thiophene-2-carboxamide
SMILESCc1nnc(-c2ccc(NC(=O)c3cccs3)cc2)o1
InChIInChI=1S/C14H11N3O2S/c1-9-16-17-14(19-9)10-4-6-11(7-5-10)15-13(18)12-3-2-8-20-12/h2-8H,1H3,(H,15,18)
InChIKeyJIXRZGZBRIXLIV-UHFFFAOYSA-N
XLogP3.36
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.33
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)thiophene-2-carboxamide
CID 6852040
N-[5-(3,5-dimethylphenyl)-1,3,4-oxadiazol-2-yl]thiophene-2-carboxamide
CID 43976618
3,4-dimethyl-N-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]benzamide
CID 110725536
N-[4-[4-(thiophene-2-carbonylamino)anilino]phenyl]thiophene-2-carboxamide
CID 67687159
2-amino-N-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]acetamide
CID 164831396
N-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]-2-phenylacetamide
CID 110725539
N-[4-(6-methoxypyridazin-3-yl)phenyl]thiophene-2-carboxamide
CID 7593583
N-[4-[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]phenyl]thiophene-2-carboxamide
CID 2203267
N-[5-(4-propan-2-ylsulfonylphenyl)-1,3,4-oxadiazol-2-yl]thiophene-2-carboxamide
CID 41226876
N-(4-acetylphenyl)thiophene-2-carboxamide
CID 573780
N-(4-sulfanylphenyl)thiophene-2-carboxamide
CID 27126639
N-[4-(7-bromo-5-ethyl-1,3-benzoxazol-2-yl)phenyl]thiophene-2-carboxamide
CID 17162877

Frequently Asked Questions

What is the IUPAC name of N-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]thiophene-2-carboxamide?
The IUPAC name of N-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]thiophene-2-carboxamide (CID 110725523) is N-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]thiophene-2-carboxamide?
The canonical SMILES for N-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]thiophene-2-carboxamide is Cc1nnc(-c2ccc(NC(=O)c3cccs3)cc2)o1.
What is the InChIKey of N-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]thiophene-2-carboxamide?
The InChIKey is JIXRZGZBRIXLIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N3O2S/c1-9-16-17-14(19-9)10-4-6-11(7-5-10)15-13(18)12-3-2-8-20-12/h2-8H,1H3,(H,15,18).
What are the key properties of N-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]thiophene-2-carboxamide?
N-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]thiophene-2-carboxamide has a molecular weight of 285.33 g/mol, XLogP of 3.36, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]thiophene-2-carboxamide is sourced from PubChem (CID 110725523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).