2-(2-formyl-3-phenylmethoxyphenoxy)acetamide

C16H15NO4 — CID 176997821

IUPAC2-(2-formyl-3-phenylmethoxyphenoxy)acetamide
SMILESNC(=O)COc1cccc(OCc2ccccc2)c1C=O
InChIInChI=1S/C16H15NO4/c17-16(19)11-21-15-8-4-7-14(13(15)9-18)20-10-12-5-2-1-3-6-12/h1-9H,10-11H2,(H2,17,19)
InChIKeyOGWRPBSVRXDUMP-UHFFFAOYSA-N
MW285.30 g/mol
LogP1.94
Rot. Bonds7

About 2-(2-formyl-3-phenylmethoxyphenoxy)acetamide

2-(2-formyl-3-phenylmethoxyphenoxy)acetamide (PubChem CID 176997821) has the molecular formula C16H15NO4 and a molecular weight of 285.30 g/mol. Its IUPAC name is 2-(2-formyl-3-phenylmethoxyphenoxy)acetamide.

Molecular Properties

Compound Name2-(2-formyl-3-phenylmethoxyphenoxy)acetamide
PubChem CID176997821
Molecular FormulaC16H15NO4
Molecular Weight285.30 g/mol
Exact Mass285.10
IUPAC Name2-(2-formyl-3-phenylmethoxyphenoxy)acetamide
SMILESNC(=O)COc1cccc(OCc2ccccc2)c1C=O
InChIInChI=1S/C16H15NO4/c17-16(19)11-21-15-8-4-7-14(13(15)9-18)20-10-12-5-2-1-3-6-12/h1-9H,10-11H2,(H2,17,19)
InChIKeyOGWRPBSVRXDUMP-UHFFFAOYSA-N
XLogP1.94
TPSA78.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.30
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-(2-formyl-3-phenylmethoxyphenoxy)acetamide 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

2,3-dihydroxy-6-phenylmethoxybenzaldehyde
CID 174450407
2-(2-benzyl-3-methoxyphenoxy)acetamide
CID 174714930
2-methoxy-4,6-bis(phenylmethoxy)benzaldehyde
CID 10980954
2-(2-hydroxyphenoxy)acetamide
CID 786426
2-hydroxy-4,6-bis(phenylmethoxy)benzaldehyde
CID 71406162
2-(3,5-dichlorophenyl)-6-phenylmethoxybenzaldehyde
CID 172993959
2-(2,3-diformylphenoxy)acetic acid
CID 163373860
2-hydroxy-3-methyl-4,6-bis(phenylmethoxy)benzaldehyde
CID 141442254
2-(4-methoxyphenyl)-6-phenylmethoxybenzaldehyde
CID 172993953
tert-butyl 4-(2-formyl-3-phenylmethoxyphenyl)benzoate
CID 178183494
2-[2,6-bis(methoxymethoxy)phenyl]-3-hydroxy-6-phenylmethoxybenzaldehyde
CID 135029831
2-phenylmethoxy-6-(4-propan-2-ylphenyl)benzaldehyde
CID 172993957

Frequently Asked Questions

What is the IUPAC name of 2-(2-formyl-3-phenylmethoxyphenoxy)acetamide?
The IUPAC name of 2-(2-formyl-3-phenylmethoxyphenoxy)acetamide (CID 176997821) is 2-(2-formyl-3-phenylmethoxyphenoxy)acetamide.
What is the SMILES notation for 2-(2-formyl-3-phenylmethoxyphenoxy)acetamide?
The canonical SMILES for 2-(2-formyl-3-phenylmethoxyphenoxy)acetamide is NC(=O)COc1cccc(OCc2ccccc2)c1C=O.
What is the InChIKey of 2-(2-formyl-3-phenylmethoxyphenoxy)acetamide?
The InChIKey is OGWRPBSVRXDUMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO4/c17-16(19)11-21-15-8-4-7-14(13(15)9-18)20-10-12-5-2-1-3-6-12/h1-9H,10-11H2,(H2,17,19).
What are the key properties of 2-(2-formyl-3-phenylmethoxyphenoxy)acetamide?
2-(2-formyl-3-phenylmethoxyphenoxy)acetamide has a molecular weight of 285.30 g/mol, XLogP of 1.94, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-formyl-3-phenylmethoxyphenoxy)acetamide is sourced from PubChem (CID 176997821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).