N-(2-imidazol-1-ylphenyl)-3,4,5-trimethoxybenzamide

C19H19N3O4 — CID 12911567

IUPACN-(2-imidazol-1-ylphenyl)-3,4,5-trimethoxybenzamide
SMILESCOc1cc(C(=O)Nc2ccccc2-n2ccnc2)cc(OC)c1OC
InChIInChI=1S/C19H19N3O4/c1-24-16-10-13(11-17(25-2)18(16)26-3)19(23)21-14-6-4-5-7-15(14)22-9-8-20-12-22/h4-12H,1-3H3,(H,21,23)
InChIKeyVNLGCWFOAGUWQQ-UHFFFAOYSA-N
MW353.38 g/mol
LogP3.15
Rot. Bonds6

About N-(2-imidazol-1-ylphenyl)-3,4,5-trimethoxybenzamide

N-(2-imidazol-1-ylphenyl)-3,4,5-trimethoxybenzamide (PubChem CID 12911567) has the molecular formula C19H19N3O4 and a molecular weight of 353.38 g/mol. Its IUPAC name is N-(2-imidazol-1-ylphenyl)-3,4,5-trimethoxybenzamide.

Molecular Properties

Compound NameN-(2-imidazol-1-ylphenyl)-3,4,5-trimethoxybenzamide
PubChem CID12911567
Molecular FormulaC19H19N3O4
Molecular Weight353.38 g/mol
Exact Mass353.14
IUPAC NameN-(2-imidazol-1-ylphenyl)-3,4,5-trimethoxybenzamide
SMILESCOc1cc(C(=O)Nc2ccccc2-n2ccnc2)cc(OC)c1OC
InChIInChI=1S/C19H19N3O4/c1-24-16-10-13(11-17(25-2)18(16)26-3)19(23)21-14-6-4-5-7-15(14)22-9-8-20-12-22/h4-12H,1-3H3,(H,21,23)
InChIKeyVNLGCWFOAGUWQQ-UHFFFAOYSA-N
XLogP3.15
TPSA74.61 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.38
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(2-imidazol-1-ylphenyl)-3,4,5-trimethoxybenzamide 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

3,4,5-trimethoxy-N-(2-pyrrol-1-ylphenyl)benzamide
CID 4689852
N-(2-imidazol-1-ylphenyl)-2-methoxybenzamide
CID 12911562
N-(3-fluoro-4-imidazol-1-ylphenyl)-3,4,5-trimethoxybenzamide
CID 47059878
N-(2-imidazol-1-ylphenyl)-4-methylbenzamide
CID 12911544
N-(2-imidazol-1-ylphenyl)-1H-pyrazole-4-carboxamide
CID 60967253
N-[(3-fluoro-4-imidazol-1-ylphenyl)methyl]-3,4,5-trimethoxybenzamide
CID 60584920
N-(2-chloro-3-pyridinyl)-3,4,5-trimethoxybenzamide
CID 3984738
3,4,5-trimethoxy-N-[2-[[2-[(3,4,5-trimethoxybenzoyl)amino]phenyl]disulfanyl]phenyl]benzamide
CID 4001036
3,4,5-trimethoxy-N-[2-[(2-methoxyphenyl)carbamoyl]phenyl]benzamide
CID 990875
N-(2-imidazol-1-ylphenyl)imidazole-1-carboxamide
CID 81257478
N-[2-(dimethylamino)phenyl]-3,4,5-trimethoxybenzamide;hydrochloride
CID 157076630
3,4,5-trimethoxy-N-(2-propan-2-yloxyphenyl)benzamide
CID 673819

Frequently Asked Questions

What is the IUPAC name of N-(2-imidazol-1-ylphenyl)-3,4,5-trimethoxybenzamide?
The IUPAC name of N-(2-imidazol-1-ylphenyl)-3,4,5-trimethoxybenzamide (CID 12911567) is N-(2-imidazol-1-ylphenyl)-3,4,5-trimethoxybenzamide.
What is the SMILES notation for N-(2-imidazol-1-ylphenyl)-3,4,5-trimethoxybenzamide?
The canonical SMILES for N-(2-imidazol-1-ylphenyl)-3,4,5-trimethoxybenzamide is COc1cc(C(=O)Nc2ccccc2-n2ccnc2)cc(OC)c1OC.
What is the InChIKey of N-(2-imidazol-1-ylphenyl)-3,4,5-trimethoxybenzamide?
The InChIKey is VNLGCWFOAGUWQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O4/c1-24-16-10-13(11-17(25-2)18(16)26-3)19(23)21-14-6-4-5-7-15(14)22-9-8-20-12-22/h4-12H,1-3H3,(H,21,23).
What are the key properties of N-(2-imidazol-1-ylphenyl)-3,4,5-trimethoxybenzamide?
N-(2-imidazol-1-ylphenyl)-3,4,5-trimethoxybenzamide has a molecular weight of 353.38 g/mol, XLogP of 3.15, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-imidazol-1-ylphenyl)-3,4,5-trimethoxybenzamide is sourced from PubChem (CID 12911567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).