N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]-2-phenoxyacetamide

C18H17N3O2 — CID 110735692

IUPACN-[4-(5-methyl-1H-imidazol-4-yl)phenyl]-2-phenoxyacetamide
SMILESCc1[nH]cnc1-c1ccc(NC(=O)COc2ccccc2)cc1
InChIInChI=1S/C18H17N3O2/c1-13-18(20-12-19-13)14-7-9-15(10-8-14)21-17(22)11-23-16-5-3-2-4-6-16/h2-10,12H,11H2,1H3,(H,19,20)(H,21,22)
InChIKeyNPSZSFZLTIUKQV-UHFFFAOYSA-N
MW307.35 g/mol
LogP3.40
Rot. Bonds5

About N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]-2-phenoxyacetamide

N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]-2-phenoxyacetamide (PubChem CID 110735692) has the molecular formula C18H17N3O2 and a molecular weight of 307.35 g/mol. Its IUPAC name is N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]-2-phenoxyacetamide.

Molecular Properties

Compound NameN-[4-(5-methyl-1H-imidazol-4-yl)phenyl]-2-phenoxyacetamide
PubChem CID110735692
Molecular FormulaC18H17N3O2
Molecular Weight307.35 g/mol
Exact Mass307.13
IUPAC NameN-[4-(5-methyl-1H-imidazol-4-yl)phenyl]-2-phenoxyacetamide
SMILESCc1[nH]cnc1-c1ccc(NC(=O)COc2ccccc2)cc1
InChIInChI=1S/C18H17N3O2/c1-13-18(20-12-19-13)14-7-9-15(10-8-14)21-17(22)11-23-16-5-3-2-4-6-16/h2-10,12H,11H2,1H3,(H,19,20)(H,21,22)
InChIKeyNPSZSFZLTIUKQV-UHFFFAOYSA-N
XLogP3.40
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-acetamidophenyl)-2-phenoxyacetamide
CID 675023
N-(5-methyl-1H-pyrazol-3-yl)-2-phenoxyacetamide
CID 47148567
2-methoxy-N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]benzamide
CID 110735682
2-(4-methylphenoxy)-N-(4-methylphenyl)acetamide
CID 681889
2-(4-acetamidophenoxy)-N-(4-phenoxyphenyl)acetamide
CID 2471722
N-(4-anilinophenyl)-2-(4-phenylphenoxy)acetamide
CID 4511463
2-[4-(4,5-diphenyl-1H-imidazol-2-yl)phenoxy]-N-(4-methoxyphenyl)acetamide
CID 155908619
N-(4-benzoylphenyl)-2-(4-methylphenoxy)acetamide
CID 837401
2-(4-methoxyphenoxy)-N-(4-phenoxyphenyl)acetamide
CID 833180
2-[4-(3,5-dimethylphenoxy)phenoxy]-N-(4-phenoxyphenyl)acetamide
CID 18870478
N-(4-methylphenyl)-2-(3-phenoxyphenoxy)acetamide
CID 23904816
N-[4-(bromomethyl)phenyl]-2-phenoxyacetamide
CID 114310874

Frequently Asked Questions

What is the IUPAC name of N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]-2-phenoxyacetamide?
The IUPAC name of N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]-2-phenoxyacetamide (CID 110735692) is N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]-2-phenoxyacetamide.
What is the SMILES notation for N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]-2-phenoxyacetamide?
The canonical SMILES for N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]-2-phenoxyacetamide is Cc1[nH]cnc1-c1ccc(NC(=O)COc2ccccc2)cc1.
What is the InChIKey of N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]-2-phenoxyacetamide?
The InChIKey is NPSZSFZLTIUKQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O2/c1-13-18(20-12-19-13)14-7-9-15(10-8-14)21-17(22)11-23-16-5-3-2-4-6-16/h2-10,12H,11H2,1H3,(H,19,20)(H,21,22).
What are the key properties of N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]-2-phenoxyacetamide?
N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]-2-phenoxyacetamide has a molecular weight of 307.35 g/mol, XLogP of 3.40, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(5-methyl-1H-imidazol-4-yl)phenyl]-2-phenoxyacetamide is sourced from PubChem (CID 110735692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).