N-[3-(2-methoxyethoxy)propyl]-4-phenylbenzamide

C19H23NO3 — CID 134029636

IUPACN-[3-(2-methoxyethoxy)propyl]-4-phenylbenzamide
SMILESCOCCOCCCNC(=O)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C19H23NO3/c1-22-14-15-23-13-5-12-20-19(21)18-10-8-17(9-11-18)16-6-3-2-4-7-16/h2-4,6-11H,5,12-15H2,1H3,(H,20,21)
InChIKeyRLUQXAFUHNELCE-UHFFFAOYSA-N
MW313.40 g/mol
LogP3.14
Rot. Bonds9

About N-[3-(2-methoxyethoxy)propyl]-4-phenylbenzamide

N-[3-(2-methoxyethoxy)propyl]-4-phenylbenzamide (PubChem CID 134029636) has the molecular formula C19H23NO3 and a molecular weight of 313.40 g/mol. Its IUPAC name is N-[3-(2-methoxyethoxy)propyl]-4-phenylbenzamide.

Molecular Properties

Compound NameN-[3-(2-methoxyethoxy)propyl]-4-phenylbenzamide
PubChem CID134029636
Molecular FormulaC19H23NO3
Molecular Weight313.40 g/mol
Exact Mass313.17
IUPAC NameN-[3-(2-methoxyethoxy)propyl]-4-phenylbenzamide
SMILESCOCCOCCCNC(=O)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C19H23NO3/c1-22-14-15-23-13-5-12-20-19(21)18-10-8-17(9-11-18)16-6-3-2-4-7-16/h2-4,6-11H,5,12-15H2,1H3,(H,20,21)
InChIKeyRLUQXAFUHNELCE-UHFFFAOYSA-N
XLogP3.14
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 53.14
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

4-[3-(2-methoxyethoxy)propylcarbamoyl]benzoic acid
CID 103790262
4-tert-butyl-N-[3-(2-methoxyethoxy)propyl]benzamide
CID 134028875
N-butyl-4-phenylbenzamide
CID 3637649
4-acetamido-N-[3-(2-methoxyethoxy)propyl]benzamide
CID 134029617
N-[2-[3-(2-methylpropoxy)propylamino]-2-oxoethyl]-4-phenylbenzamide
CID 51218463
N-(3-acetamidopropyl)-4-phenylbenzamide
CID 38450168
N-(3-prop-2-enoxypropyl)benzamide
CID 10775246
N-(3-methoxypropyl)-4-(2-phenoxypyrimidin-5-yl)benzamide
CID 53116798
N-[3-(2-methoxyethoxy)propyl]-6-phenoxypyridine-3-carboxamide
CID 87002549
N-(3-methoxypropyl)-4-pyridin-2-ylbenzamide
CID 110464861
N-(3-methoxypropyl)-6-phenylpyridine-3-carboxamide
CID 110683628
4-[(2-fluorophenyl)sulfamoyl]-N-[3-(2-methoxyethoxy)propyl]benzamide
CID 55407931

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-methoxyethoxy)propyl]-4-phenylbenzamide?
The IUPAC name of N-[3-(2-methoxyethoxy)propyl]-4-phenylbenzamide (CID 134029636) is N-[3-(2-methoxyethoxy)propyl]-4-phenylbenzamide.
What is the SMILES notation for N-[3-(2-methoxyethoxy)propyl]-4-phenylbenzamide?
The canonical SMILES for N-[3-(2-methoxyethoxy)propyl]-4-phenylbenzamide is COCCOCCCNC(=O)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of N-[3-(2-methoxyethoxy)propyl]-4-phenylbenzamide?
The InChIKey is RLUQXAFUHNELCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO3/c1-22-14-15-23-13-5-12-20-19(21)18-10-8-17(9-11-18)16-6-3-2-4-7-16/h2-4,6-11H,5,12-15H2,1H3,(H,20,21).
What are the key properties of N-[3-(2-methoxyethoxy)propyl]-4-phenylbenzamide?
N-[3-(2-methoxyethoxy)propyl]-4-phenylbenzamide has a molecular weight of 313.40 g/mol, XLogP of 3.14, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-methoxyethoxy)propyl]-4-phenylbenzamide is sourced from PubChem (CID 134029636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).