N-(4-ethylphenyl)-2-imidazol-1-ylpyridine-4-carboxamide

C17H16N4O — CID 87010836

IUPACN-(4-ethylphenyl)-2-imidazol-1-ylpyridine-4-carboxamide
SMILESCCc1ccc(NC(=O)c2ccnc(-n3ccnc3)c2)cc1
InChIInChI=1S/C17H16N4O/c1-2-13-3-5-15(6-4-13)20-17(22)14-7-8-19-16(11-14)21-10-9-18-12-21/h3-12H,2H2,1H3,(H,20,22)
InChIKeyJYSKYTDEVJEFOA-UHFFFAOYSA-N
MW292.34 g/mol
LogP3.08
Rot. Bonds4

About N-(4-ethylphenyl)-2-imidazol-1-ylpyridine-4-carboxamide

N-(4-ethylphenyl)-2-imidazol-1-ylpyridine-4-carboxamide (PubChem CID 87010836) has the molecular formula C17H16N4O and a molecular weight of 292.34 g/mol. Its IUPAC name is N-(4-ethylphenyl)-2-imidazol-1-ylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-(4-ethylphenyl)-2-imidazol-1-ylpyridine-4-carboxamide
PubChem CID87010836
Molecular FormulaC17H16N4O
Molecular Weight292.34 g/mol
Exact Mass292.13
IUPAC NameN-(4-ethylphenyl)-2-imidazol-1-ylpyridine-4-carboxamide
SMILESCCc1ccc(NC(=O)c2ccnc(-n3ccnc3)c2)cc1
InChIInChI=1S/C17H16N4O/c1-2-13-3-5-15(6-4-13)20-17(22)14-7-8-19-16(11-14)21-10-9-18-12-21/h3-12H,2H2,1H3,(H,20,22)
InChIKeyJYSKYTDEVJEFOA-UHFFFAOYSA-N
XLogP3.08
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-imidazol-1-yl-N-[4-[(3-methylpiperidin-1-yl)methyl]phenyl]pyridine-4-carboxamide
CID 87045978
2-bromo-N-(4-ethylphenyl)pyridine-4-carboxamide
CID 113255068
2-imidazol-1-yl-N-(3-methyl-2H-indazol-6-yl)pyridine-4-carboxamide
CID 75439961
2-imidazol-1-yl-N-(5-methyl-1H-imidazol-2-yl)pyridine-4-carboxamide
CID 75430489
N-(4-methylphenyl)-2-(1,2,4-triazol-4-yl)pyridine-4-carboxamide
CID 39890492
N-(1-hydroxypentan-3-yl)-2-imidazol-1-ylpyridine-4-carboxamide
CID 109478737
N-[4-(diethylamino)-4-oxobutyl]-2-imidazol-1-ylpyridine-4-carboxamide
CID 51090160
2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N-(4-ethylphenyl)pyridine-4-carboxamide
CID 109174046
N-(4-chloro-2-hydroxyphenyl)-2-imidazol-1-ylpyridine-4-carboxamide
CID 75432250
2-imidazol-1-yl-N-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]pyridine-4-carboxamide
CID 136528207
4-N-(4-acetylphenyl)-2-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide
CID 109092310
N-[[3-(ethoxymethyl)phenyl]methyl]-2-imidazol-1-ylpyridine-4-carboxamide
CID 47068369

Frequently Asked Questions

What is the IUPAC name of N-(4-ethylphenyl)-2-imidazol-1-ylpyridine-4-carboxamide?
The IUPAC name of N-(4-ethylphenyl)-2-imidazol-1-ylpyridine-4-carboxamide (CID 87010836) is N-(4-ethylphenyl)-2-imidazol-1-ylpyridine-4-carboxamide.
What is the SMILES notation for N-(4-ethylphenyl)-2-imidazol-1-ylpyridine-4-carboxamide?
The canonical SMILES for N-(4-ethylphenyl)-2-imidazol-1-ylpyridine-4-carboxamide is CCc1ccc(NC(=O)c2ccnc(-n3ccnc3)c2)cc1.
What is the InChIKey of N-(4-ethylphenyl)-2-imidazol-1-ylpyridine-4-carboxamide?
The InChIKey is JYSKYTDEVJEFOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O/c1-2-13-3-5-15(6-4-13)20-17(22)14-7-8-19-16(11-14)21-10-9-18-12-21/h3-12H,2H2,1H3,(H,20,22).
What are the key properties of N-(4-ethylphenyl)-2-imidazol-1-ylpyridine-4-carboxamide?
N-(4-ethylphenyl)-2-imidazol-1-ylpyridine-4-carboxamide has a molecular weight of 292.34 g/mol, XLogP of 3.08, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylphenyl)-2-imidazol-1-ylpyridine-4-carboxamide is sourced from PubChem (CID 87010836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).