N-(2,6-diethylphenyl)-1H-imidazole-5-carboxamide

C14H17N3O — CID 110684342

IUPACN-(2,6-diethylphenyl)-1H-imidazole-5-carboxamide
SMILESCCc1cccc(CC)c1NC(=O)c1cnc[nH]1
InChIInChI=1S/C14H17N3O/c1-3-10-6-5-7-11(4-2)13(10)17-14(18)12-8-15-9-16-12/h5-9H,3-4H2,1-2H3,(H,15,16)(H,17,18)
InChIKeyYTTMURKSWVWFCC-UHFFFAOYSA-N
MW243.31 g/mol
LogP2.79
Rot. Bonds4

About N-(2,6-diethylphenyl)-1H-imidazole-5-carboxamide

N-(2,6-diethylphenyl)-1H-imidazole-5-carboxamide (PubChem CID 110684342) has the molecular formula C14H17N3O and a molecular weight of 243.31 g/mol. Its IUPAC name is N-(2,6-diethylphenyl)-1H-imidazole-5-carboxamide.

Molecular Properties

Compound NameN-(2,6-diethylphenyl)-1H-imidazole-5-carboxamide
PubChem CID110684342
Molecular FormulaC14H17N3O
Molecular Weight243.31 g/mol
Exact Mass243.14
IUPAC NameN-(2,6-diethylphenyl)-1H-imidazole-5-carboxamide
SMILESCCc1cccc(CC)c1NC(=O)c1cnc[nH]1
InChIInChI=1S/C14H17N3O/c1-3-10-6-5-7-11(4-2)13(10)17-14(18)12-8-15-9-16-12/h5-9H,3-4H2,1-2H3,(H,15,16)(H,17,18)
InChIKeyYTTMURKSWVWFCC-UHFFFAOYSA-N
XLogP2.79
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(2,6-diethylphenyl)-1H-imidazole-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2,6-diethylphenyl)-2-(1H-imidazol-5-yl)acetamide
CID 110684155
4-amino-N-(2,6-diethylphenyl)-1H-pyrrole-2-carboxamide
CID 43642713
4-bromo-N-(2,6-diethylphenyl)-1H-pyrrole-2-carboxamide
CID 43410595
2,6-diethyl-N-(1H-imidazol-5-ylmethyl)aniline
CID 13178302
N-(2,6-diethylphenyl)-2-oxo-1H-pyridine-4-carboxamide
CID 110600773
7-chloro-N-(2,6-diethylphenyl)-1H-indole-2-carboxamide
CID 108791658
4-amino-N-(2,6-diethylphenyl)pyridine-3-carboxamide
CID 81235051
N-(4-octylphenyl)-1H-imidazole-5-carboxamide
CID 177471524
N-(2,6-diethylphenyl)pyridine-2-carboxamide
CID 19224278
5-chloro-N-(2,6-diethylphenyl)pyrazine-2-carboxamide
CID 107371744
N-(2,6-diethylphenyl)-5-methylpyrazine-2-carboxamide
CID 17441034
5-N-tert-butyl-3-N-(2,6-diethylphenyl)pyridine-3,5-dicarboxamide
CID 109106930

Frequently Asked Questions

What is the IUPAC name of N-(2,6-diethylphenyl)-1H-imidazole-5-carboxamide?
The IUPAC name of N-(2,6-diethylphenyl)-1H-imidazole-5-carboxamide (CID 110684342) is N-(2,6-diethylphenyl)-1H-imidazole-5-carboxamide.
What is the SMILES notation for N-(2,6-diethylphenyl)-1H-imidazole-5-carboxamide?
The canonical SMILES for N-(2,6-diethylphenyl)-1H-imidazole-5-carboxamide is CCc1cccc(CC)c1NC(=O)c1cnc[nH]1.
What is the InChIKey of N-(2,6-diethylphenyl)-1H-imidazole-5-carboxamide?
The InChIKey is YTTMURKSWVWFCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O/c1-3-10-6-5-7-11(4-2)13(10)17-14(18)12-8-15-9-16-12/h5-9H,3-4H2,1-2H3,(H,15,16)(H,17,18).
What are the key properties of N-(2,6-diethylphenyl)-1H-imidazole-5-carboxamide?
N-(2,6-diethylphenyl)-1H-imidazole-5-carboxamide has a molecular weight of 243.31 g/mol, XLogP of 2.79, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-diethylphenyl)-1H-imidazole-5-carboxamide is sourced from PubChem (CID 110684342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).