N-benzyl-5-methyl-2-(2-oxo-4-phenylmethoxy-1-pyridinyl)-1H-imidazole-4-carboxamide

C24H22N4O3 — CID 24985616

IUPACN-benzyl-5-methyl-2-(2-oxo-4-phenylmethoxy-1-pyridinyl)-1H-imidazole-4-carboxamide
SMILESCc1[nH]c(-n2ccc(OCc3ccccc3)cc2=O)nc1C(=O)NCc1ccccc1
InChIInChI=1S/C24H22N4O3/c1-17-22(23(30)25-15-18-8-4-2-5-9-18)27-24(26-17)28-13-12-20(14-21(28)29)31-16-19-10-6-3-7-11-19/h2-14H,15-16H2,1H3,(H,25,30)(H,26,27)
InChIKeyQENDOXHDZZUKIE-UHFFFAOYSA-N
MW414.47 g/mol
LogP3.38
Rot. Bonds7

About N-benzyl-5-methyl-2-(2-oxo-4-phenylmethoxy-1-pyridinyl)-1H-imidazole-4-carboxamide

N-benzyl-5-methyl-2-(2-oxo-4-phenylmethoxy-1-pyridinyl)-1H-imidazole-4-carboxamide (PubChem CID 24985616) has the molecular formula C24H22N4O3 and a molecular weight of 414.47 g/mol. Its IUPAC name is N-benzyl-5-methyl-2-(2-oxo-4-phenylmethoxy-1-pyridinyl)-1H-imidazole-4-carboxamide.

Molecular Properties

Compound NameN-benzyl-5-methyl-2-(2-oxo-4-phenylmethoxy-1-pyridinyl)-1H-imidazole-4-carboxamide
PubChem CID24985616
Molecular FormulaC24H22N4O3
Molecular Weight414.47 g/mol
Exact Mass414.17
IUPAC NameN-benzyl-5-methyl-2-(2-oxo-4-phenylmethoxy-1-pyridinyl)-1H-imidazole-4-carboxamide
SMILESCc1[nH]c(-n2ccc(OCc3ccccc3)cc2=O)nc1C(=O)NCc1ccccc1
InChIInChI=1S/C24H22N4O3/c1-17-22(23(30)25-15-18-8-4-2-5-9-18)27-24(26-17)28-13-12-20(14-21(28)29)31-16-19-10-6-3-7-11-19/h2-14H,15-16H2,1H3,(H,25,30)(H,26,27)
InChIKeyQENDOXHDZZUKIE-UHFFFAOYSA-N
XLogP3.38
TPSA89.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.47
LogP ≤ 53.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 3,5-dimethyl-2-(2-oxo-4-phenylmethoxy-1-pyridinyl)imidazole-4-carboxylate
CID 24985949
4-phenylmethoxy-1-[4-(propylamino)phenyl]pyridin-2-one
CID 24780169
1-(4-iodo-3-methylphenyl)-4-phenylmethoxypyridin-2-one
CID 143591111
N-benzyl-5-[4-(2-cyclopropylethoxy)-2-oxo-1-pyridinyl]-3-methylthiophene-2-carboxamide
CID 24985791
N-benzyl-4-methyl-2-(2-oxo-6-phenylmethoxyquinolin-1-yl)-1,3-thiazole-5-carboxamide
CID 24985614
3,5-dimethyl-N-[(3-phenylmethoxyphenyl)methyl]-1H-pyrrole-2-carboxamide
CID 167782072
6-methyl-4-oxo-1-phenyl-N-[(3-phenylmethoxyphenyl)methyl]pyridazine-3-carboxamide
CID 55846918
1-(4-bromophenyl)-4-phenylmethoxypyridin-2-one
CID 59187025
1-(1-methylindazol-5-yl)-4-phenylmethoxypyridin-2-one
CID 143723289
1-[4-methyl-5-(3-phenylpropanoyl)thiophen-2-yl]-4-phenylmethoxypyridin-2-one
CID 162219045
1-[4-[2-(dimethylamino)ethylamino]phenyl]-4-phenylmethoxypyridin-2-one
CID 24780171
N-[(3-methylphenyl)methyl]-3-phenylmethoxybenzamide
CID 50875108

Frequently Asked Questions

What is the IUPAC name of N-benzyl-5-methyl-2-(2-oxo-4-phenylmethoxy-1-pyridinyl)-1H-imidazole-4-carboxamide?
The IUPAC name of N-benzyl-5-methyl-2-(2-oxo-4-phenylmethoxy-1-pyridinyl)-1H-imidazole-4-carboxamide (CID 24985616) is N-benzyl-5-methyl-2-(2-oxo-4-phenylmethoxy-1-pyridinyl)-1H-imidazole-4-carboxamide.
What is the SMILES notation for N-benzyl-5-methyl-2-(2-oxo-4-phenylmethoxy-1-pyridinyl)-1H-imidazole-4-carboxamide?
The canonical SMILES for N-benzyl-5-methyl-2-(2-oxo-4-phenylmethoxy-1-pyridinyl)-1H-imidazole-4-carboxamide is Cc1[nH]c(-n2ccc(OCc3ccccc3)cc2=O)nc1C(=O)NCc1ccccc1.
What is the InChIKey of N-benzyl-5-methyl-2-(2-oxo-4-phenylmethoxy-1-pyridinyl)-1H-imidazole-4-carboxamide?
The InChIKey is QENDOXHDZZUKIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N4O3/c1-17-22(23(30)25-15-18-8-4-2-5-9-18)27-24(26-17)28-13-12-20(14-21(28)29)31-16-19-10-6-3-7-11-19/h2-14H,15-16H2,1H3,(H,25,30)(H,26,27).
What are the key properties of N-benzyl-5-methyl-2-(2-oxo-4-phenylmethoxy-1-pyridinyl)-1H-imidazole-4-carboxamide?
N-benzyl-5-methyl-2-(2-oxo-4-phenylmethoxy-1-pyridinyl)-1H-imidazole-4-carboxamide has a molecular weight of 414.47 g/mol, XLogP of 3.38, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-5-methyl-2-(2-oxo-4-phenylmethoxy-1-pyridinyl)-1H-imidazole-4-carboxamide is sourced from PubChem (CID 24985616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).