N,N-dibenzyl-1H-imidazole-5-carboxamide

C18H17N3O — CID 141124431

IUPACN,N-dibenzyl-1H-imidazole-5-carboxamide
SMILESO=C(c1cnc[nH]1)N(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C18H17N3O/c22-18(17-11-19-14-20-17)21(12-15-7-3-1-4-8-15)13-16-9-5-2-6-10-16/h1-11,14H,12-13H2,(H,19,20)
InChIKeyUJUAJARZNXFAKL-UHFFFAOYSA-N
MW291.35 g/mol
LogP3.25
Rot. Bonds5

About N,N-dibenzyl-1H-imidazole-5-carboxamide

N,N-dibenzyl-1H-imidazole-5-carboxamide (PubChem CID 141124431) has the molecular formula C18H17N3O and a molecular weight of 291.35 g/mol. Its IUPAC name is N,N-dibenzyl-1H-imidazole-5-carboxamide.

Molecular Properties

Compound NameN,N-dibenzyl-1H-imidazole-5-carboxamide
PubChem CID141124431
Molecular FormulaC18H17N3O
Molecular Weight291.35 g/mol
Exact Mass291.14
IUPAC NameN,N-dibenzyl-1H-imidazole-5-carboxamide
SMILESO=C(c1cnc[nH]1)N(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C18H17N3O/c22-18(17-11-19-14-20-17)21(12-15-7-3-1-4-8-15)13-16-9-5-2-6-10-16/h1-11,14H,12-13H2,(H,19,20)
InChIKeyUJUAJARZNXFAKL-UHFFFAOYSA-N
XLogP3.25
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-N-(pyridin-4-ylmethyl)-1H-imidazole-5-carboxamide
CID 123395094
N-benzyl-N-methyl-6-oxo-1H-pyrimidine-5-carboxamide
CID 110851137
N,N-dibenzyl-3-phenyl-1H-pyrazole-5-carboxamide
CID 18870925
N,N-dibenzyl-2-pyridin-3-yl-1H-imidazole-5-carboxamide
CID 59768233
4-(dibenzylcarbamoyl)benzoic acid
CID 67563328
N-benzyl-N-(2-hydroxyethyl)-1H-pyrrole-2-carboxamide
CID 60682006
N-[(4-phenylphenyl)methyl]-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 42796236
1H-imidazole-5-carboxylic acid;dihydrate
CID 140542846
bis(1H-imidazole-5-carboxylic acid);manganese
CID 134691385
N-(1H-imidazol-5-ylmethyl)-4-oxo-N-[(4-phenylphenyl)methyl]chromene-3-carboxamide
CID 42786027
N-[[1-[(2-methylphenyl)methyl]piperidin-4-yl]methyl]-N-(pyridin-3-ylmethyl)-1H-imidazole-5-carboxamide
CID 72931964
2-amino-N,N-dibenzyl-2-[2-(1H-imidazol-5-yl)ethyl]-3-methylbutanamide
CID 161184673

Frequently Asked Questions

What is the IUPAC name of N,N-dibenzyl-1H-imidazole-5-carboxamide?
The IUPAC name of N,N-dibenzyl-1H-imidazole-5-carboxamide (CID 141124431) is N,N-dibenzyl-1H-imidazole-5-carboxamide.
What is the SMILES notation for N,N-dibenzyl-1H-imidazole-5-carboxamide?
The canonical SMILES for N,N-dibenzyl-1H-imidazole-5-carboxamide is O=C(c1cnc[nH]1)N(Cc1ccccc1)Cc1ccccc1.
What is the InChIKey of N,N-dibenzyl-1H-imidazole-5-carboxamide?
The InChIKey is UJUAJARZNXFAKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O/c22-18(17-11-19-14-20-17)21(12-15-7-3-1-4-8-15)13-16-9-5-2-6-10-16/h1-11,14H,12-13H2,(H,19,20).
What are the key properties of N,N-dibenzyl-1H-imidazole-5-carboxamide?
N,N-dibenzyl-1H-imidazole-5-carboxamide has a molecular weight of 291.35 g/mol, XLogP of 3.25, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibenzyl-1H-imidazole-5-carboxamide is sourced from PubChem (CID 141124431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).