N-[4-[2-(N-ethylanilino)-2-oxoethyl]phenyl]-3-phenylpropanamide

C25H26N2O2 — CID 55817357

IUPACN-[4-[2-(N-ethylanilino)-2-oxoethyl]phenyl]-3-phenylpropanamide
SMILESCCN(C(=O)Cc1ccc(NC(=O)CCc2ccccc2)cc1)c1ccccc1
InChIInChI=1S/C25H26N2O2/c1-2-27(23-11-7-4-8-12-23)25(29)19-21-13-16-22(17-14-21)26-24(28)18-15-20-9-5-3-6-10-20/h3-14,16-17H,2,15,18-19H2,1H3,(H,26,28)
InChIKeyUBFSLDIGHIGLNP-UHFFFAOYSA-N
MW386.50 g/mol
LogP4.85
Rot. Bonds8

About N-[4-[2-(N-ethylanilino)-2-oxoethyl]phenyl]-3-phenylpropanamide

N-[4-[2-(N-ethylanilino)-2-oxoethyl]phenyl]-3-phenylpropanamide (PubChem CID 55817357) has the molecular formula C25H26N2O2 and a molecular weight of 386.50 g/mol. Its IUPAC name is N-[4-[2-(N-ethylanilino)-2-oxoethyl]phenyl]-3-phenylpropanamide.

Molecular Properties

Compound NameN-[4-[2-(N-ethylanilino)-2-oxoethyl]phenyl]-3-phenylpropanamide
PubChem CID55817357
Molecular FormulaC25H26N2O2
Molecular Weight386.50 g/mol
Exact Mass386.20
IUPAC NameN-[4-[2-(N-ethylanilino)-2-oxoethyl]phenyl]-3-phenylpropanamide
SMILESCCN(C(=O)Cc1ccc(NC(=O)CCc2ccccc2)cc1)c1ccccc1
InChIInChI=1S/C25H26N2O2/c1-2-27(23-11-7-4-8-12-23)25(29)19-21-13-16-22(17-14-21)26-24(28)18-15-20-9-5-3-6-10-20/h3-14,16-17H,2,15,18-19H2,1H3,(H,26,28)
InChIKeyUBFSLDIGHIGLNP-UHFFFAOYSA-N
XLogP4.85
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.50
LogP ≤ 54.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]-N-[4-[2-(N-ethylanilino)-2-oxoethyl]phenyl]propanamide
CID 52663082
N-[4-[3-(dimethylamino)-3-oxopropyl]phenyl]-3-phenylpropanamide
CID 42643106
2-phenyl-N-(4-propylphenyl)acetamide
CID 126501660
N-ethyl-2-[4-[(2-hydroxy-2-phenylethyl)carbamoylamino]phenyl]-N-phenylacetamide
CID 112838540
1-amino-N-[4-[2-(N-ethylanilino)-2-oxoethyl]phenyl]cyclopropane-1-carboxamide;hydrochloride
CID 119717908
N-[4-(dimethylamino)phenyl]-3-phenylpropanamide
CID 874810
2-[4-[3-(4-ethylphenyl)propanoylamino]phenyl]acetic acid
CID 45346474
N-[4-[2-(N-ethylanilino)-2-oxoethyl]phenyl]-2-pyrrolidin-2-ylacetamide
CID 119717935
(2S)-2-amino-N-[4-[2-(N-ethylanilino)-2-oxoethyl]phenyl]-4-methylpentanamide
CID 119717943
N-[4-[2-(N-ethylanilino)-2-oxoethyl]phenyl]-3,4-dimethylbenzamide
CID 55891914
2-[4-[[2-(2,4-dimethylphenoxy)acetyl]amino]phenyl]-N-ethyl-N-phenylacetamide
CID 55817645
N-(4-methylphenyl)-3-phenylpropanamide
CID 778861

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(N-ethylanilino)-2-oxoethyl]phenyl]-3-phenylpropanamide?
The IUPAC name of N-[4-[2-(N-ethylanilino)-2-oxoethyl]phenyl]-3-phenylpropanamide (CID 55817357) is N-[4-[2-(N-ethylanilino)-2-oxoethyl]phenyl]-3-phenylpropanamide.
What is the SMILES notation for N-[4-[2-(N-ethylanilino)-2-oxoethyl]phenyl]-3-phenylpropanamide?
The canonical SMILES for N-[4-[2-(N-ethylanilino)-2-oxoethyl]phenyl]-3-phenylpropanamide is CCN(C(=O)Cc1ccc(NC(=O)CCc2ccccc2)cc1)c1ccccc1.
What is the InChIKey of N-[4-[2-(N-ethylanilino)-2-oxoethyl]phenyl]-3-phenylpropanamide?
The InChIKey is UBFSLDIGHIGLNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N2O2/c1-2-27(23-11-7-4-8-12-23)25(29)19-21-13-16-22(17-14-21)26-24(28)18-15-20-9-5-3-6-10-20/h3-14,16-17H,2,15,18-19H2,1H3,(H,26,28).
What are the key properties of N-[4-[2-(N-ethylanilino)-2-oxoethyl]phenyl]-3-phenylpropanamide?
N-[4-[2-(N-ethylanilino)-2-oxoethyl]phenyl]-3-phenylpropanamide has a molecular weight of 386.50 g/mol, XLogP of 4.85, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-(N-ethylanilino)-2-oxoethyl]phenyl]-3-phenylpropanamide is sourced from PubChem (CID 55817357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).