N-benzyl-N-ethyl-2-(4-phenylmethoxyanilino)acetamide

C24H26N2O2 — CID 108999046

IUPACN-benzyl-N-ethyl-2-(4-phenylmethoxyanilino)acetamide
SMILESCCN(Cc1ccccc1)C(=O)CNc1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C24H26N2O2/c1-2-26(18-20-9-5-3-6-10-20)24(27)17-25-22-13-15-23(16-14-22)28-19-21-11-7-4-8-12-21/h3-16,25H,2,17-19H2,1H3
InChIKeyYDQMUHXGRNROFZ-UHFFFAOYSA-N
MW374.48 g/mol
LogP4.73
Rot. Bonds9

About N-benzyl-N-ethyl-2-(4-phenylmethoxyanilino)acetamide

N-benzyl-N-ethyl-2-(4-phenylmethoxyanilino)acetamide (PubChem CID 108999046) has the molecular formula C24H26N2O2 and a molecular weight of 374.48 g/mol. Its IUPAC name is N-benzyl-N-ethyl-2-(4-phenylmethoxyanilino)acetamide.

Molecular Properties

Compound NameN-benzyl-N-ethyl-2-(4-phenylmethoxyanilino)acetamide
PubChem CID108999046
Molecular FormulaC24H26N2O2
Molecular Weight374.48 g/mol
Exact Mass374.20
IUPAC NameN-benzyl-N-ethyl-2-(4-phenylmethoxyanilino)acetamide
SMILESCCN(Cc1ccccc1)C(=O)CNc1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C24H26N2O2/c1-2-26(18-20-9-5-3-6-10-20)24(27)17-25-22-13-15-23(16-14-22)28-19-21-11-7-4-8-12-21/h3-16,25H,2,17-19H2,1H3
InChIKeyYDQMUHXGRNROFZ-UHFFFAOYSA-N
XLogP4.73
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.48
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

Analyze N-benzyl-N-ethyl-2-(4-phenylmethoxyanilino)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[[2-[ethyl-[(4-phenylmethoxyphenyl)methyl]amino]-2-oxoethyl]amino]-N-methylacetamide
CID 8772652
N,N-diethyl-4-[[2-(4-phenylmethoxyanilino)acetyl]amino]benzamide
CID 37221073
ethyl 2-(4-phenylmethoxyanilino)acetate
CID 3652798
N-benzyl-N-methyl-2-[4-(2-phenoxyethoxy)anilino]acetamide
CID 54821466
2-anilino-N-ethyl-N-(pyridin-4-ylmethyl)acetamide
CID 60962477
N,N-diethyl-4-phenylmethoxybenzamide
CID 4958372
N-benzyl-N-ethyl-2-(2-phenoxyanilino)acetamide
CID 108999057
4-[[2-oxo-2-(4-phenylmethoxyanilino)ethyl]amino]-N,N-dipropylbenzamide
CID 54832179
2-anilino-N-benzyl-N-propylacetamide;hydrochloride
CID 119681623
N-benzyl-N-ethyl-2-[2-(4-methoxyphenoxy)ethylamino]acetamide
CID 108998980
methyl 3-[[2-[benzyl(ethyl)amino]-2-oxoethyl]amino]benzoate
CID 108999033
N-benzyl-2-(3-cyanoanilino)-N-ethylacetamide
CID 32899277

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-ethyl-2-(4-phenylmethoxyanilino)acetamide?
The IUPAC name of N-benzyl-N-ethyl-2-(4-phenylmethoxyanilino)acetamide (CID 108999046) is N-benzyl-N-ethyl-2-(4-phenylmethoxyanilino)acetamide.
What is the SMILES notation for N-benzyl-N-ethyl-2-(4-phenylmethoxyanilino)acetamide?
The canonical SMILES for N-benzyl-N-ethyl-2-(4-phenylmethoxyanilino)acetamide is CCN(Cc1ccccc1)C(=O)CNc1ccc(OCc2ccccc2)cc1.
What is the InChIKey of N-benzyl-N-ethyl-2-(4-phenylmethoxyanilino)acetamide?
The InChIKey is YDQMUHXGRNROFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O2/c1-2-26(18-20-9-5-3-6-10-20)24(27)17-25-22-13-15-23(16-14-22)28-19-21-11-7-4-8-12-21/h3-16,25H,2,17-19H2,1H3.
What are the key properties of N-benzyl-N-ethyl-2-(4-phenylmethoxyanilino)acetamide?
N-benzyl-N-ethyl-2-(4-phenylmethoxyanilino)acetamide has a molecular weight of 374.48 g/mol, XLogP of 4.73, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-ethyl-2-(4-phenylmethoxyanilino)acetamide is sourced from PubChem (CID 108999046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).