N-ethyl-N-phenyl-3-(2-phenylethoxy)benzamide

C23H23NO2 — CID 17134260

IUPACN-ethyl-N-phenyl-3-(2-phenylethoxy)benzamide
SMILESCCN(C(=O)c1cccc(OCCc2ccccc2)c1)c1ccccc1
InChIInChI=1S/C23H23NO2/c1-2-24(21-13-7-4-8-14-21)23(25)20-12-9-15-22(18-20)26-17-16-19-10-5-3-6-11-19/h3-15,18H,2,16-17H2,1H3
InChIKeyIIGYCFSRTFKPQN-UHFFFAOYSA-N
MW345.44 g/mol
LogP4.97
Rot. Bonds7

About N-ethyl-N-phenyl-3-(2-phenylethoxy)benzamide

N-ethyl-N-phenyl-3-(2-phenylethoxy)benzamide (PubChem CID 17134260) has the molecular formula C23H23NO2 and a molecular weight of 345.44 g/mol. Its IUPAC name is N-ethyl-N-phenyl-3-(2-phenylethoxy)benzamide.

Molecular Properties

Compound NameN-ethyl-N-phenyl-3-(2-phenylethoxy)benzamide
PubChem CID17134260
Molecular FormulaC23H23NO2
Molecular Weight345.44 g/mol
Exact Mass345.17
IUPAC NameN-ethyl-N-phenyl-3-(2-phenylethoxy)benzamide
SMILESCCN(C(=O)c1cccc(OCCc2ccccc2)c1)c1ccccc1
InChIInChI=1S/C23H23NO2/c1-2-24(21-13-7-4-8-14-21)23(25)20-12-9-15-22(18-20)26-17-16-19-10-5-3-6-11-19/h3-15,18H,2,16-17H2,1H3
InChIKeyIIGYCFSRTFKPQN-UHFFFAOYSA-N
XLogP4.97
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.44
LogP ≤ 54.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-phenyl-3-(2-phenylethoxy)benzamide?
The IUPAC name of N-ethyl-N-phenyl-3-(2-phenylethoxy)benzamide (CID 17134260) is N-ethyl-N-phenyl-3-(2-phenylethoxy)benzamide.
What is the SMILES notation for N-ethyl-N-phenyl-3-(2-phenylethoxy)benzamide?
The canonical SMILES for N-ethyl-N-phenyl-3-(2-phenylethoxy)benzamide is CCN(C(=O)c1cccc(OCCc2ccccc2)c1)c1ccccc1.
What is the InChIKey of N-ethyl-N-phenyl-3-(2-phenylethoxy)benzamide?
The InChIKey is IIGYCFSRTFKPQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23NO2/c1-2-24(21-13-7-4-8-14-21)23(25)20-12-9-15-22(18-20)26-17-16-19-10-5-3-6-11-19/h3-15,18H,2,16-17H2,1H3.
What are the key properties of N-ethyl-N-phenyl-3-(2-phenylethoxy)benzamide?
N-ethyl-N-phenyl-3-(2-phenylethoxy)benzamide has a molecular weight of 345.44 g/mol, XLogP of 4.97, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-phenyl-3-(2-phenylethoxy)benzamide is sourced from PubChem (CID 17134260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).