2-formyl-N-methyl-4-phenoxybenzamide

C15H13NO3 — CID 141490804

IUPAC2-formyl-N-methyl-4-phenoxybenzamide
SMILESCNC(=O)c1ccc(Oc2ccccc2)cc1C=O
InChIInChI=1S/C15H13NO3/c1-16-15(18)14-8-7-13(9-11(14)10-17)19-12-5-3-2-4-6-12/h2-10H,1H3,(H,16,18)
InChIKeyNIURFZBNZSOMSR-UHFFFAOYSA-N
MW255.27 g/mol
LogP2.65
Rot. Bonds4

About 2-formyl-N-methyl-4-phenoxybenzamide

2-formyl-N-methyl-4-phenoxybenzamide (PubChem CID 141490804) has the molecular formula C15H13NO3 and a molecular weight of 255.27 g/mol. Its IUPAC name is 2-formyl-N-methyl-4-phenoxybenzamide.

Molecular Properties

Compound Name2-formyl-N-methyl-4-phenoxybenzamide
PubChem CID141490804
Molecular FormulaC15H13NO3
Molecular Weight255.27 g/mol
Exact Mass255.09
IUPAC Name2-formyl-N-methyl-4-phenoxybenzamide
SMILESCNC(=O)c1ccc(Oc2ccccc2)cc1C=O
InChIInChI=1S/C15H13NO3/c1-16-15(18)14-8-7-13(9-11(14)10-17)19-12-5-3-2-4-6-12/h2-10H,1H3,(H,16,18)
InChIKeyNIURFZBNZSOMSR-UHFFFAOYSA-N
XLogP2.65
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.27
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze 2-formyl-N-methyl-4-phenoxybenzamide 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-dimethyl-5-phenoxybenzamide
CID 135275179
methyl 2-ethenyl-4-phenoxybenzoate
CID 154641334
5-[4-[2-[4-[4-[3-(2,6-dimethylphenyl)pentan-3-ylcarbamoyl]-3-formylphenoxy]phenyl]propan-2-yl]phenoxy]-2-formyl-N-methylbenzamide
CID 88854026
2-chloro-5-phenoxybenzaldehyde
CID 131420183
2,4-diphenoxybenzaldehyde
CID 87301631
3-(4-bromophenoxy)-N-methylbenzamide
CID 169337021
4-methoxy-N-methyl-2-(2-oxo-1-phenylethyl)benzamide
CID 86610237
2-chloro-N-methyl-5-[(4-phenoxybenzoyl)amino]benzamide
CID 55835370
2-ethyl-4-phenoxybenzoic acid;tungsten
CID 167701074
2-methoxycarbonyl-4-phenoxybenzoic acid
CID 142601044
1-[2-hydroxy-4-(4-phenoxyphenoxy)phenyl]ethanone
CID 166874046
2-formyl-4-(2-phenylethynyl)-N-propan-2-ylbenzamide
CID 147850041

Frequently Asked Questions

What is the IUPAC name of 2-formyl-N-methyl-4-phenoxybenzamide?
The IUPAC name of 2-formyl-N-methyl-4-phenoxybenzamide (CID 141490804) is 2-formyl-N-methyl-4-phenoxybenzamide.
What is the SMILES notation for 2-formyl-N-methyl-4-phenoxybenzamide?
The canonical SMILES for 2-formyl-N-methyl-4-phenoxybenzamide is CNC(=O)c1ccc(Oc2ccccc2)cc1C=O.
What is the InChIKey of 2-formyl-N-methyl-4-phenoxybenzamide?
The InChIKey is NIURFZBNZSOMSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO3/c1-16-15(18)14-8-7-13(9-11(14)10-17)19-12-5-3-2-4-6-12/h2-10H,1H3,(H,16,18).
What are the key properties of 2-formyl-N-methyl-4-phenoxybenzamide?
2-formyl-N-methyl-4-phenoxybenzamide has a molecular weight of 255.27 g/mol, XLogP of 2.65, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-formyl-N-methyl-4-phenoxybenzamide is sourced from PubChem (CID 141490804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).