N,N-dimethyl-4-(2-phenoxyethoxy)benzamide

C17H19NO3 — CID 28639806

IUPACN,N-dimethyl-4-(2-phenoxyethoxy)benzamide
SMILESCN(C)C(=O)c1ccc(OCCOc2ccccc2)cc1
InChIInChI=1S/C17H19NO3/c1-18(2)17(19)14-8-10-16(11-9-14)21-13-12-20-15-6-4-3-5-7-15/h3-11H,12-13H2,1-2H3
InChIKeyZUQBROSOTNCAHF-UHFFFAOYSA-N
MW285.34 g/mol
LogP2.85
Rot. Bonds6

About N,N-dimethyl-4-(2-phenoxyethoxy)benzamide

N,N-dimethyl-4-(2-phenoxyethoxy)benzamide (PubChem CID 28639806) has the molecular formula C17H19NO3 and a molecular weight of 285.34 g/mol. Its IUPAC name is N,N-dimethyl-4-(2-phenoxyethoxy)benzamide.

Molecular Properties

Compound NameN,N-dimethyl-4-(2-phenoxyethoxy)benzamide
PubChem CID28639806
Molecular FormulaC17H19NO3
Molecular Weight285.34 g/mol
Exact Mass285.14
IUPAC NameN,N-dimethyl-4-(2-phenoxyethoxy)benzamide
SMILESCN(C)C(=O)c1ccc(OCCOc2ccccc2)cc1
InChIInChI=1S/C17H19NO3/c1-18(2)17(19)14-8-10-16(11-9-14)21-13-12-20-15-6-4-3-5-7-15/h3-11H,12-13H2,1-2H3
InChIKeyZUQBROSOTNCAHF-UHFFFAOYSA-N
XLogP2.85
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.34
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-ethyl-4-(2-phenoxyethoxy)-N-phenylbenzamide
CID 4952665
N-[4-[2-[2-[2-[4-[benzoyl(methyl)amino]phenoxy]ethoxy]ethoxy]ethoxy]phenyl]-N-methylbenzamide
CID 59720906
N,N-dimethyl-4-[3-[(2-phenoxyacetyl)amino]prop-1-ynyl]benzamide
CID 90550076
benzoic acid;bis(4-(2-methoxyethoxy)benzoic acid)
CID 91308161
4-benzoyl-N,N-dimethylbenzamide
CID 12779824
4-[2-[3-(dimethylamino)phenoxy]ethoxy]benzoic acid
CID 20985248
N-methyl-N-[2-(4-methylphenoxy)ethyl]benzamide
CID 60676178
N,N-dimethyl-4-[[2-[4-(3-phenylpropoxy)anilino]acetyl]amino]benzamide
CID 54825579
[4-[2-(dimethylamino)ethoxy]phenyl]-phenylmethanone;molybdenum
CID 159586330
N,N-dimethyl-4-[(4-methylphenoxy)methyl]benzamide
CID 86978503
N,N-dimethyl-3-propoxybenzamide
CID 28639811
4-[[[N-[[4-(2-methoxyethoxy)phenyl]methyl]-N'-methylcarbamimidoyl]amino]methyl]-N,N-dimethylbenzamide;hydroiodide
CID 111873230

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-(2-phenoxyethoxy)benzamide?
The IUPAC name of N,N-dimethyl-4-(2-phenoxyethoxy)benzamide (CID 28639806) is N,N-dimethyl-4-(2-phenoxyethoxy)benzamide.
What is the SMILES notation for N,N-dimethyl-4-(2-phenoxyethoxy)benzamide?
The canonical SMILES for N,N-dimethyl-4-(2-phenoxyethoxy)benzamide is CN(C)C(=O)c1ccc(OCCOc2ccccc2)cc1.
What is the InChIKey of N,N-dimethyl-4-(2-phenoxyethoxy)benzamide?
The InChIKey is ZUQBROSOTNCAHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO3/c1-18(2)17(19)14-8-10-16(11-9-14)21-13-12-20-15-6-4-3-5-7-15/h3-11H,12-13H2,1-2H3.
What are the key properties of N,N-dimethyl-4-(2-phenoxyethoxy)benzamide?
N,N-dimethyl-4-(2-phenoxyethoxy)benzamide has a molecular weight of 285.34 g/mol, XLogP of 2.85, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-(2-phenoxyethoxy)benzamide is sourced from PubChem (CID 28639806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).