N-[4-(4,5-dimethylimidazol-1-yl)phenyl]-5,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide

C19H20N4O2 — CID 166327105

IUPACN-[4-(4,5-dimethylimidazol-1-yl)phenyl]-5,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide
SMILESCc1cc(C(=O)Nc2ccc(-n3cnc(C)c3C)cc2)c(=O)[nH]c1C
InChIInChI=1S/C19H20N4O2/c1-11-9-17(18(24)21-12(11)2)19(25)22-15-5-7-16(8-6-15)23-10-20-13(3)14(23)4/h5-10H,1-4H3,(H,21,24)(H,22,25)
InChIKeyUJNAHNUCXQYCFF-UHFFFAOYSA-N
MW336.40 g/mol
LogP3.05
Rot. Bonds3

About N-[4-(4,5-dimethylimidazol-1-yl)phenyl]-5,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide

N-[4-(4,5-dimethylimidazol-1-yl)phenyl]-5,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 166327105) has the molecular formula C19H20N4O2 and a molecular weight of 336.40 g/mol. Its IUPAC name is N-[4-(4,5-dimethylimidazol-1-yl)phenyl]-5,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[4-(4,5-dimethylimidazol-1-yl)phenyl]-5,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide
PubChem CID166327105
Molecular FormulaC19H20N4O2
Molecular Weight336.40 g/mol
Exact Mass336.16
IUPAC NameN-[4-(4,5-dimethylimidazol-1-yl)phenyl]-5,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide
SMILESCc1cc(C(=O)Nc2ccc(-n3cnc(C)c3C)cc2)c(=O)[nH]c1C
InChIInChI=1S/C19H20N4O2/c1-11-9-17(18(24)21-12(11)2)19(25)22-15-5-7-16(8-6-15)23-10-20-13(3)14(23)4/h5-10H,1-4H3,(H,21,24)(H,22,25)
InChIKeyUJNAHNUCXQYCFF-UHFFFAOYSA-N
XLogP3.05
TPSA79.78 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 53.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(4,5-dimethylimidazol-1-yl)phenyl]-2-methyl-1H-pyrrole-3-carboxamide
CID 166215842
N-[4-(4,5-dimethylimidazol-1-yl)phenyl]-2,4-dimethyl-1,3-oxazole-5-carboxamide
CID 166215741
N-[4-(4,5-dimethylimidazol-1-yl)phenyl]-3-methylpyridine-2-carboxamide
CID 166215509
N-[4-(4,5-dimethylimidazol-1-yl)phenyl]-1,5-dimethylpyrrole-3-carboxamide
CID 166327019
N-[4-(4,5-dimethylimidazol-1-yl)phenyl]-3-methylbutanamide
CID 166215592
N-[4-(4,5-dimethylimidazol-1-yl)phenyl]furan-3-carboxamide
CID 166215679
N-[4-(4,5-dimethylimidazol-1-yl)phenyl]-6-methylpyridine-3-carboxamide
CID 166215479
2-chloro-N-[4-(4,5-dimethylimidazol-1-yl)phenyl]-5-(methylsulfamoyl)benzamide
CID 166215814
N-[4-(4,5-dimethylimidazol-1-yl)phenyl]furan-2-carboxamide
CID 166215878
5-cyano-N-[4-(4,5-dimethylimidazol-1-yl)phenyl]furan-2-carboxamide
CID 166197115
N-[4-(4,5-dimethylimidazol-1-yl)phenyl]-3-ethoxy-1H-pyrazole-5-carboxamide
CID 166327015
N-[4-(4,5-dimethylimidazol-1-yl)phenyl]-2-(2,4-dioxo-1H-pyrimidin-6-yl)acetamide
CID 166350115

Frequently Asked Questions

What is the IUPAC name of N-[4-(4,5-dimethylimidazol-1-yl)phenyl]-5,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-[4-(4,5-dimethylimidazol-1-yl)phenyl]-5,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide (CID 166327105) is N-[4-(4,5-dimethylimidazol-1-yl)phenyl]-5,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-[4-(4,5-dimethylimidazol-1-yl)phenyl]-5,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-[4-(4,5-dimethylimidazol-1-yl)phenyl]-5,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide is Cc1cc(C(=O)Nc2ccc(-n3cnc(C)c3C)cc2)c(=O)[nH]c1C.
What is the InChIKey of N-[4-(4,5-dimethylimidazol-1-yl)phenyl]-5,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is UJNAHNUCXQYCFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O2/c1-11-9-17(18(24)21-12(11)2)19(25)22-15-5-7-16(8-6-15)23-10-20-13(3)14(23)4/h5-10H,1-4H3,(H,21,24)(H,22,25).
What are the key properties of N-[4-(4,5-dimethylimidazol-1-yl)phenyl]-5,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide?
N-[4-(4,5-dimethylimidazol-1-yl)phenyl]-5,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 336.40 g/mol, XLogP of 3.05, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4,5-dimethylimidazol-1-yl)phenyl]-5,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 166327105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).