3-(2-phenoxyethoxy)-N-(1-phenylethyl)benzamide

C23H23NO3 — CID 4954951

IUPAC3-(2-phenoxyethoxy)-N-(1-phenylethyl)benzamide
SMILESCC(NC(=O)c1cccc(OCCOc2ccccc2)c1)c1ccccc1
InChIInChI=1S/C23H23NO3/c1-18(19-9-4-2-5-10-19)24-23(25)20-11-8-14-22(17-20)27-16-15-26-21-12-6-3-7-13-21/h2-14,17-18H,15-16H2,1H3,(H,24,25)
InChIKeyAXSMRUJFDPJXOC-UHFFFAOYSA-N
MW361.44 g/mol
LogP4.64
Rot. Bonds8

About 3-(2-phenoxyethoxy)-N-(1-phenylethyl)benzamide

3-(2-phenoxyethoxy)-N-(1-phenylethyl)benzamide (PubChem CID 4954951) has the molecular formula C23H23NO3 and a molecular weight of 361.44 g/mol. Its IUPAC name is 3-(2-phenoxyethoxy)-N-(1-phenylethyl)benzamide.

Molecular Properties

Compound Name3-(2-phenoxyethoxy)-N-(1-phenylethyl)benzamide
PubChem CID4954951
Molecular FormulaC23H23NO3
Molecular Weight361.44 g/mol
Exact Mass361.17
IUPAC Name3-(2-phenoxyethoxy)-N-(1-phenylethyl)benzamide
SMILESCC(NC(=O)c1cccc(OCCOc2ccccc2)c1)c1ccccc1
InChIInChI=1S/C23H23NO3/c1-18(19-9-4-2-5-10-19)24-23(25)20-11-8-14-22(17-20)27-16-15-26-21-12-6-3-7-13-21/h2-14,17-18H,15-16H2,1H3,(H,24,25)
InChIKeyAXSMRUJFDPJXOC-UHFFFAOYSA-N
XLogP4.64
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.44
LogP ≤ 54.64
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

3-[[3-(2-phenoxyethoxy)benzoyl]carbamothioylamino]-N-(1-phenylethyl)benzamide
CID 43878045
N-(1-phenylethyl)-3-pyrimidin-2-yloxybenzamide
CID 70703950
3-[(2-phenoxyacetyl)amino]-N-(1-phenylethyl)benzamide
CID 43877736
4-[[2-[3-(2-phenoxyethoxy)anilino]acetyl]amino]-N-(1-phenylethyl)benzamide
CID 54825206
N'-benzoyl-3-(2-phenoxyethoxy)benzohydrazide
CID 4955128
3-ethoxy-N-[(1R)-1-pyridin-4-ylethyl]benzamide
CID 40637184
N-[(1R)-1-(4-ethoxyphenyl)ethyl]-3-methoxybenzamide
CID 33300897
3-ethoxy-N-[(1R)-1-(4-methoxyphenyl)ethyl]benzamide
CID 1252585
4-(phenoxymethyl)-N-(1-phenylethyl)benzamide
CID 112759831
N-[3-(2-phenoxyethoxy)phenyl]-3-propan-2-yloxybenzamide
CID 17142503
3-methoxy-N-[(2S)-1-oxo-1-[[(1S)-1-phenylethyl]amino]propan-2-yl]benzamide
CID 122195499
1-N-butan-2-yl-3-N-(1-phenylethyl)benzene-1,3-dicarboxamide
CID 109051451

Frequently Asked Questions

What is the IUPAC name of 3-(2-phenoxyethoxy)-N-(1-phenylethyl)benzamide?
The IUPAC name of 3-(2-phenoxyethoxy)-N-(1-phenylethyl)benzamide (CID 4954951) is 3-(2-phenoxyethoxy)-N-(1-phenylethyl)benzamide.
What is the SMILES notation for 3-(2-phenoxyethoxy)-N-(1-phenylethyl)benzamide?
The canonical SMILES for 3-(2-phenoxyethoxy)-N-(1-phenylethyl)benzamide is CC(NC(=O)c1cccc(OCCOc2ccccc2)c1)c1ccccc1.
What is the InChIKey of 3-(2-phenoxyethoxy)-N-(1-phenylethyl)benzamide?
The InChIKey is AXSMRUJFDPJXOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23NO3/c1-18(19-9-4-2-5-10-19)24-23(25)20-11-8-14-22(17-20)27-16-15-26-21-12-6-3-7-13-21/h2-14,17-18H,15-16H2,1H3,(H,24,25).
What are the key properties of 3-(2-phenoxyethoxy)-N-(1-phenylethyl)benzamide?
3-(2-phenoxyethoxy)-N-(1-phenylethyl)benzamide has a molecular weight of 361.44 g/mol, XLogP of 4.64, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-phenoxyethoxy)-N-(1-phenylethyl)benzamide is sourced from PubChem (CID 4954951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).