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

C18H14N6O2 — CID 136528207

IUPAC2-imidazol-1-yl-N-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]pyridine-4-carboxamide
SMILESCc1nnc(-c2cccc(NC(=O)c3ccnc(-n4ccnc4)c3)c2)o1
InChIInChI=1S/C18H14N6O2/c1-12-22-23-18(26-12)14-3-2-4-15(9-14)21-17(25)13-5-6-20-16(10-13)24-8-7-19-11-24/h2-11H,1H3,(H,21,25)
InChIKeyAMERDZZUBMDTFL-UHFFFAOYSA-N
MW346.35 g/mol
LogP2.88
Rot. Bonds4

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

2-imidazol-1-yl-N-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]pyridine-4-carboxamide (PubChem CID 136528207) has the molecular formula C18H14N6O2 and a molecular weight of 346.35 g/mol. Its IUPAC name is 2-imidazol-1-yl-N-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-imidazol-1-yl-N-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]pyridine-4-carboxamide
PubChem CID136528207
Molecular FormulaC18H14N6O2
Molecular Weight346.35 g/mol
Exact Mass346.12
IUPAC Name2-imidazol-1-yl-N-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]pyridine-4-carboxamide
SMILESCc1nnc(-c2cccc(NC(=O)c3ccnc(-n4ccnc4)c3)c2)o1
InChIInChI=1S/C18H14N6O2/c1-12-22-23-18(26-12)14-3-2-4-15(9-14)21-17(25)13-5-6-20-16(10-13)24-8-7-19-11-24/h2-11H,1H3,(H,21,25)
InChIKeyAMERDZZUBMDTFL-UHFFFAOYSA-N
XLogP2.88
TPSA98.73 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.35
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-imidazol-1-yl-N-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]pyridine-4-carboxamide?
The IUPAC name of 2-imidazol-1-yl-N-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]pyridine-4-carboxamide (CID 136528207) is 2-imidazol-1-yl-N-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]pyridine-4-carboxamide.
What is the SMILES notation for 2-imidazol-1-yl-N-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]pyridine-4-carboxamide?
The canonical SMILES for 2-imidazol-1-yl-N-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]pyridine-4-carboxamide is Cc1nnc(-c2cccc(NC(=O)c3ccnc(-n4ccnc4)c3)c2)o1.
What is the InChIKey of 2-imidazol-1-yl-N-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]pyridine-4-carboxamide?
The InChIKey is AMERDZZUBMDTFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N6O2/c1-12-22-23-18(26-12)14-3-2-4-15(9-14)21-17(25)13-5-6-20-16(10-13)24-8-7-19-11-24/h2-11H,1H3,(H,21,25).
What are the key properties of 2-imidazol-1-yl-N-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]pyridine-4-carboxamide?
2-imidazol-1-yl-N-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]pyridine-4-carboxamide has a molecular weight of 346.35 g/mol, XLogP of 2.88, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-imidazol-1-yl-N-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]pyridine-4-carboxamide is sourced from PubChem (CID 136528207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).