N,N-dibenzyl-2-pyridin-3-yl-1H-imidazole-5-carboxamide

C23H20N4O — CID 59768233

IUPACN,N-dibenzyl-2-pyridin-3-yl-1H-imidazole-5-carboxamide
SMILESO=C(c1cnc(-c2cccnc2)[nH]1)N(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C23H20N4O/c28-23(21-15-25-22(26-21)20-12-7-13-24-14-20)27(16-18-8-3-1-4-9-18)17-19-10-5-2-6-11-19/h1-15H,16-17H2,(H,25,26)
InChIKeyJMVVNALRUCKQGX-UHFFFAOYSA-N
MW368.44 g/mol
LogP4.31
Rot. Bonds6

About N,N-dibenzyl-2-pyridin-3-yl-1H-imidazole-5-carboxamide

N,N-dibenzyl-2-pyridin-3-yl-1H-imidazole-5-carboxamide (PubChem CID 59768233) has the molecular formula C23H20N4O and a molecular weight of 368.44 g/mol. Its IUPAC name is N,N-dibenzyl-2-pyridin-3-yl-1H-imidazole-5-carboxamide.

Molecular Properties

Compound NameN,N-dibenzyl-2-pyridin-3-yl-1H-imidazole-5-carboxamide
PubChem CID59768233
Molecular FormulaC23H20N4O
Molecular Weight368.44 g/mol
Exact Mass368.16
IUPAC NameN,N-dibenzyl-2-pyridin-3-yl-1H-imidazole-5-carboxamide
SMILESO=C(c1cnc(-c2cccnc2)[nH]1)N(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C23H20N4O/c28-23(21-15-25-22(26-21)20-12-7-13-24-14-20)27(16-18-8-3-1-4-9-18)17-19-10-5-2-6-11-19/h1-15H,16-17H2,(H,25,26)
InChIKeyJMVVNALRUCKQGX-UHFFFAOYSA-N
XLogP4.31
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.44
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-phenylphenyl)methyl]-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 42796236
2-(2-methylpropyl)-N-(pyridin-3-ylmethyl)-N-(pyridin-4-ylmethyl)-1H-imidazole-5-carboxamide
CID 126809690
N,N-dibenzyl-1H-imidazole-5-carboxamide
CID 141124431
N-[(4-phenylphenyl)methyl]-N-(pyridin-3-ylmethyl)thiadiazole-4-carboxamide
CID 42796243
N-[(4-chlorophenyl)methyl]-6-oxo-N-propyl-2-pyridin-3-yl-1H-pyrimidine-5-carboxamide
CID 72870603
N,N-dibenzyl-3-phenyl-1H-pyrazole-5-carboxamide
CID 18870925
2-phenyl-1H-imidazole-5-carboxylic acid;hydrate
CID 2738138
N-[(4-but-2-ynoxyphenyl)methyl]-4-phenyl-N-(pyridin-3-ylmethyl)benzamide
CID 42429960
N-benzyl-N-ethyl-2-pyridin-3-yl-1,3-thiazole-4-carboxamide
CID 110648241
N-benzyl-N-ethylpyridine-3-carboxamide;hydrochloride
CID 110755487
N-benzyl-2-methyl-N-(pyridin-3-ylmethyl)-1,8-naphthyridine-3-carboxamide
CID 171678671
N-ethyl-6-oxo-N-(2-phenylsulfanylethyl)-2-pyridin-3-yl-1H-pyrimidine-5-carboxamide
CID 72928061

Frequently Asked Questions

What is the IUPAC name of N,N-dibenzyl-2-pyridin-3-yl-1H-imidazole-5-carboxamide?
The IUPAC name of N,N-dibenzyl-2-pyridin-3-yl-1H-imidazole-5-carboxamide (CID 59768233) is N,N-dibenzyl-2-pyridin-3-yl-1H-imidazole-5-carboxamide.
What is the SMILES notation for N,N-dibenzyl-2-pyridin-3-yl-1H-imidazole-5-carboxamide?
The canonical SMILES for N,N-dibenzyl-2-pyridin-3-yl-1H-imidazole-5-carboxamide is O=C(c1cnc(-c2cccnc2)[nH]1)N(Cc1ccccc1)Cc1ccccc1.
What is the InChIKey of N,N-dibenzyl-2-pyridin-3-yl-1H-imidazole-5-carboxamide?
The InChIKey is JMVVNALRUCKQGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N4O/c28-23(21-15-25-22(26-21)20-12-7-13-24-14-20)27(16-18-8-3-1-4-9-18)17-19-10-5-2-6-11-19/h1-15H,16-17H2,(H,25,26).
What are the key properties of N,N-dibenzyl-2-pyridin-3-yl-1H-imidazole-5-carboxamide?
N,N-dibenzyl-2-pyridin-3-yl-1H-imidazole-5-carboxamide has a molecular weight of 368.44 g/mol, XLogP of 4.31, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibenzyl-2-pyridin-3-yl-1H-imidazole-5-carboxamide is sourced from PubChem (CID 59768233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).