5-methyl-N-[[5-(6-methyl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]methyl]thiophene-3-carboxamide

C15H14N4O2S — CID 92559013

IUPAC5-methyl-N-[[5-(6-methyl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]methyl]thiophene-3-carboxamide
SMILESCc1ccc(-c2nnc(CNC(=O)c3csc(C)c3)o2)cn1
InChIInChI=1S/C15H14N4O2S/c1-9-3-4-11(6-16-9)15-19-18-13(21-15)7-17-14(20)12-5-10(2)22-8-12/h3-6,8H,7H2,1-2H3,(H,17,20)
InChIKeyWIIOQWXYVOBDIP-UHFFFAOYSA-N
MW314.37 g/mol
LogP2.74
Rot. Bonds4

About 5-methyl-N-[[5-(6-methyl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]methyl]thiophene-3-carboxamide

5-methyl-N-[[5-(6-methyl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]methyl]thiophene-3-carboxamide (PubChem CID 92559013) has the molecular formula C15H14N4O2S and a molecular weight of 314.37 g/mol. Its IUPAC name is 5-methyl-N-[[5-(6-methyl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]methyl]thiophene-3-carboxamide.

Molecular Properties

Compound Name5-methyl-N-[[5-(6-methyl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]methyl]thiophene-3-carboxamide
PubChem CID92559013
Molecular FormulaC15H14N4O2S
Molecular Weight314.37 g/mol
Exact Mass314.08
IUPAC Name5-methyl-N-[[5-(6-methyl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]methyl]thiophene-3-carboxamide
SMILESCc1ccc(-c2nnc(CNC(=O)c3csc(C)c3)o2)cn1
InChIInChI=1S/C15H14N4O2S/c1-9-3-4-11(6-16-9)15-19-18-13(21-15)7-17-14(20)12-5-10(2)22-8-12/h3-6,8H,7H2,1-2H3,(H,17,20)
InChIKeyWIIOQWXYVOBDIP-UHFFFAOYSA-N
XLogP2.74
TPSA80.91 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.37
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5-methyl-N-[[5-(6-methyl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]methyl]thiophene-3-carboxamide with MolForge

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Related Compounds

3-methyl-N-[[5-(6-methyl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]methyl]-1-propylpyrazole-4-carboxamide
CID 46956962
2-(2,6-dimethoxyphenoxy)-N-[[5-(6-methyl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]methyl]acetamide
CID 92559006
N-[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl]-3-methylbenzamide
CID 110319780
2-(4-tert-butylphenoxy)-N-[[5-(6-methyl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]methyl]acetamide
CID 92559007
3,5-dimethoxy-N-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)methyl]benzamide
CID 110318682
4-tert-butyl-N-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl]benzamide
CID 110319544
2-[5-(6-methyl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]ethanamine
CID 62069885
2-(2-chloroethyl)-5-(6-methyl-3-pyridinyl)-1,3,4-oxadiazole
CID 43513255
3-(4-fluorophenyl)-N-[[5-(5-methylthiophen-2-yl)-1,3,4-oxadiazol-2-yl]methyl]benzamide
CID 92559623
3,4,5-trimethoxy-N-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)methyl]benzamide
CID 110318833
N-[[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl]-4-(trifluoromethyl)benzamide
CID 110319435
3-methoxy-N-[[5-(4-methyl-1,3-thiazol-5-yl)-1,3,4-oxadiazol-2-yl]methyl]benzamide
CID 92598926

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-[[5-(6-methyl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]methyl]thiophene-3-carboxamide?
The IUPAC name of 5-methyl-N-[[5-(6-methyl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]methyl]thiophene-3-carboxamide (CID 92559013) is 5-methyl-N-[[5-(6-methyl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]methyl]thiophene-3-carboxamide.
What is the SMILES notation for 5-methyl-N-[[5-(6-methyl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]methyl]thiophene-3-carboxamide?
The canonical SMILES for 5-methyl-N-[[5-(6-methyl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]methyl]thiophene-3-carboxamide is Cc1ccc(-c2nnc(CNC(=O)c3csc(C)c3)o2)cn1.
What is the InChIKey of 5-methyl-N-[[5-(6-methyl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]methyl]thiophene-3-carboxamide?
The InChIKey is WIIOQWXYVOBDIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O2S/c1-9-3-4-11(6-16-9)15-19-18-13(21-15)7-17-14(20)12-5-10(2)22-8-12/h3-6,8H,7H2,1-2H3,(H,17,20).
What are the key properties of 5-methyl-N-[[5-(6-methyl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]methyl]thiophene-3-carboxamide?
5-methyl-N-[[5-(6-methyl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]methyl]thiophene-3-carboxamide has a molecular weight of 314.37 g/mol, XLogP of 2.74, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[[5-(6-methyl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]methyl]thiophene-3-carboxamide is sourced from PubChem (CID 92559013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).