6-imidazol-1-yl-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide

C16H16N4O2 — CID 134001981

IUPAC6-imidazol-1-yl-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide
SMILESCc1ccc(C(C)NC(=O)c2ccc(-n3ccnc3)nc2)o1
InChIInChI=1S/C16H16N4O2/c1-11-3-5-14(22-11)12(2)19-16(21)13-4-6-15(18-9-13)20-8-7-17-10-20/h3-10,12H,1-2H3,(H,19,21)
InChIKeyVEXNXKRUWYTYJU-UHFFFAOYSA-N
MW296.33 g/mol
LogP2.66
Rot. Bonds4

About 6-imidazol-1-yl-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide

6-imidazol-1-yl-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide (PubChem CID 134001981) has the molecular formula C16H16N4O2 and a molecular weight of 296.33 g/mol. Its IUPAC name is 6-imidazol-1-yl-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-imidazol-1-yl-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide
PubChem CID134001981
Molecular FormulaC16H16N4O2
Molecular Weight296.33 g/mol
Exact Mass296.13
IUPAC Name6-imidazol-1-yl-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide
SMILESCc1ccc(C(C)NC(=O)c2ccc(-n3ccnc3)nc2)o1
InChIInChI=1S/C16H16N4O2/c1-11-3-5-14(22-11)12(2)19-16(21)13-4-6-15(18-9-13)20-8-7-17-10-20/h3-10,12H,1-2H3,(H,19,21)
InChIKeyVEXNXKRUWYTYJU-UHFFFAOYSA-N
XLogP2.66
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.33
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(6-imidazol-1-ylpyridine-3-carbonyl)amino]propanoic acid
CID 43355195
6-imidazol-1-yl-N-[1-(5-methylfuran-2-yl)ethyl]pyridin-3-amine
CID 43710701
6-imidazol-1-yl-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-3-carboxamide
CID 103856069
6-imidazol-1-yl-N-[(1R)-1-thiophen-2-ylethyl]pyridine-3-carboxamide
CID 51725269
N-[1-(4-ethoxyphenyl)ethyl]-6-imidazol-1-ylpyridine-3-carboxamide
CID 134001965
N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-6-imidazol-1-ylpyridine-3-carboxamide
CID 79246612
N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-6-imidazol-1-ylpyridine-3-carboxamide
CID 51931107
N-[1-(1,3-benzodioxol-5-yl)ethyl]-6-imidazol-1-ylpyridine-3-carboxamide
CID 134002047
6-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N-[(1R)-1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide
CID 36700403
6-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N-[(1S)-1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide
CID 36700400
6-fluoro-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide
CID 63977964
ethane;6-imidazol-1-yl-N-methylpyridine-3-carboxamide
CID 142231779

Frequently Asked Questions

What is the IUPAC name of 6-imidazol-1-yl-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide?
The IUPAC name of 6-imidazol-1-yl-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide (CID 134001981) is 6-imidazol-1-yl-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-imidazol-1-yl-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide?
The canonical SMILES for 6-imidazol-1-yl-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide is Cc1ccc(C(C)NC(=O)c2ccc(-n3ccnc3)nc2)o1.
What is the InChIKey of 6-imidazol-1-yl-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide?
The InChIKey is VEXNXKRUWYTYJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O2/c1-11-3-5-14(22-11)12(2)19-16(21)13-4-6-15(18-9-13)20-8-7-17-10-20/h3-10,12H,1-2H3,(H,19,21).
What are the key properties of 6-imidazol-1-yl-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide?
6-imidazol-1-yl-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide has a molecular weight of 296.33 g/mol, XLogP of 2.66, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-imidazol-1-yl-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide is sourced from PubChem (CID 134001981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).