4-methoxy-3-methyl-N-(2-phenoxyethyl)benzamide

C17H19NO3 — CID 100543454

IUPAC4-methoxy-3-methyl-N-(2-phenoxyethyl)benzamide
SMILESCOc1ccc(C(=O)NCCOc2ccccc2)cc1C
InChIInChI=1S/C17H19NO3/c1-13-12-14(8-9-16(13)20-2)17(19)18-10-11-21-15-6-4-3-5-7-15/h3-9,12H,10-11H2,1-2H3,(H,18,19)
InChIKeyMQPQDOWHFKXHPR-UHFFFAOYSA-N
MW285.34 g/mol
LogP2.81
Rot. Bonds6

About 4-methoxy-3-methyl-N-(2-phenoxyethyl)benzamide

4-methoxy-3-methyl-N-(2-phenoxyethyl)benzamide (PubChem CID 100543454) has the molecular formula C17H19NO3 and a molecular weight of 285.34 g/mol. Its IUPAC name is 4-methoxy-3-methyl-N-(2-phenoxyethyl)benzamide.

Molecular Properties

Compound Name4-methoxy-3-methyl-N-(2-phenoxyethyl)benzamide
PubChem CID100543454
Molecular FormulaC17H19NO3
Molecular Weight285.34 g/mol
Exact Mass285.14
IUPAC Name4-methoxy-3-methyl-N-(2-phenoxyethyl)benzamide
SMILESCOc1ccc(C(=O)NCCOc2ccccc2)cc1C
InChIInChI=1S/C17H19NO3/c1-13-12-14(8-9-16(13)20-2)17(19)18-10-11-21-15-6-4-3-5-7-15/h3-9,12H,10-11H2,1-2H3,(H,18,19)
InChIKeyMQPQDOWHFKXHPR-UHFFFAOYSA-N
XLogP2.81
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.34
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(3-methoxyphenoxy)ethyl]-3,4-dimethylbenzamide
CID 94051659
3,4-dimethoxy-N-[2-(3-phenoxyphenoxy)ethyl]benzamide
CID 4065417
3-methoxy-N-(3-phenoxypropyl)-4-phenylmethoxybenzamide
CID 55431173
6-methoxy-N-(2-phenoxyethyl)naphthalene-2-carboxamide
CID 5302937
3-(difluoromethoxy)-4-methoxy-N-(3-phenoxypropyl)benzamide
CID 55739120
3,4-dimethyl-N-[2-(3-phenoxypropanoylamino)ethyl]benzamide
CID 108542336
N-benzyl-4-methoxy-3-methylbenzamide
CID 17018002
N-[2-(3,4-dimethylphenoxy)ethyl]-4-ethoxy-3-methylbenzamide
CID 100560116
4-methoxy-3-[(4-methylphenyl)sulfamoyl]-N-(2-phenoxyethyl)benzamide
CID 55348301
N-[2-(2,6-dimethylphenoxy)ethyl]-3,4-dimethoxybenzamide
CID 2173279
3-ethoxy-N-(2-methoxyethyl)-4-(2-phenoxyethoxy)benzamide
CID 35810602
3-ethoxy-4-methoxy-N-[2-(3-methylphenoxy)ethyl]benzamide
CID 31916381

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-3-methyl-N-(2-phenoxyethyl)benzamide?
The IUPAC name of 4-methoxy-3-methyl-N-(2-phenoxyethyl)benzamide (CID 100543454) is 4-methoxy-3-methyl-N-(2-phenoxyethyl)benzamide.
What is the SMILES notation for 4-methoxy-3-methyl-N-(2-phenoxyethyl)benzamide?
The canonical SMILES for 4-methoxy-3-methyl-N-(2-phenoxyethyl)benzamide is COc1ccc(C(=O)NCCOc2ccccc2)cc1C.
What is the InChIKey of 4-methoxy-3-methyl-N-(2-phenoxyethyl)benzamide?
The InChIKey is MQPQDOWHFKXHPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO3/c1-13-12-14(8-9-16(13)20-2)17(19)18-10-11-21-15-6-4-3-5-7-15/h3-9,12H,10-11H2,1-2H3,(H,18,19).
What are the key properties of 4-methoxy-3-methyl-N-(2-phenoxyethyl)benzamide?
4-methoxy-3-methyl-N-(2-phenoxyethyl)benzamide has a molecular weight of 285.34 g/mol, XLogP of 2.81, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-3-methyl-N-(2-phenoxyethyl)benzamide is sourced from PubChem (CID 100543454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).