2-(N-ethylanilino)-N-[[2-(phenylmethoxymethyl)phenyl]methyl]acetamide

C25H28N2O2 — CID 60512306

IUPAC2-(N-ethylanilino)-N-[[2-(phenylmethoxymethyl)phenyl]methyl]acetamide
SMILESCCN(CC(=O)NCc1ccccc1COCc1ccccc1)c1ccccc1
InChIInChI=1S/C25H28N2O2/c1-2-27(24-15-7-4-8-16-24)18-25(28)26-17-22-13-9-10-14-23(22)20-29-19-21-11-5-3-6-12-21/h3-16H,2,17-20H2,1H3,(H,26,28)
InChIKeyLXQHNHQPTPFPLO-UHFFFAOYSA-N
MW388.51 g/mol
LogP4.55
Rot. Bonds10

About 2-(N-ethylanilino)-N-[[2-(phenylmethoxymethyl)phenyl]methyl]acetamide

2-(N-ethylanilino)-N-[[2-(phenylmethoxymethyl)phenyl]methyl]acetamide (PubChem CID 60512306) has the molecular formula C25H28N2O2 and a molecular weight of 388.51 g/mol. Its IUPAC name is 2-(N-ethylanilino)-N-[[2-(phenylmethoxymethyl)phenyl]methyl]acetamide.

Molecular Properties

Compound Name2-(N-ethylanilino)-N-[[2-(phenylmethoxymethyl)phenyl]methyl]acetamide
PubChem CID60512306
Molecular FormulaC25H28N2O2
Molecular Weight388.51 g/mol
Exact Mass388.22
IUPAC Name2-(N-ethylanilino)-N-[[2-(phenylmethoxymethyl)phenyl]methyl]acetamide
SMILESCCN(CC(=O)NCc1ccccc1COCc1ccccc1)c1ccccc1
InChIInChI=1S/C25H28N2O2/c1-2-27(24-15-7-4-8-16-24)18-25(28)26-17-22-13-9-10-14-23(22)20-29-19-21-11-5-3-6-12-21/h3-16H,2,17-20H2,1H3,(H,26,28)
InChIKeyLXQHNHQPTPFPLO-UHFFFAOYSA-N
XLogP4.55
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.51
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-[[2-(phenylmethoxymethyl)phenyl]methyl]propanamide;hydrochloride
CID 119286417
2-(4-bromophenyl)-N-[[2-(phenylmethoxymethyl)phenyl]methyl]acetamide
CID 55694421
methyl (2R)-2-methyl-4-oxo-4-[[2-(phenylmethoxymethyl)phenyl]methylamino]butanoate
CID 97019366
(2R)-2-amino-N-[[2-(phenylmethoxymethyl)phenyl]methyl]propanamide
CID 119286428
4-amino-3-methoxy-N-[[2-(phenylmethoxymethyl)phenyl]methyl]butanamide;hydrochloride
CID 120588541
N-[[4-(diethylamino)phenyl]methyl]-2-phenylacetamide
CID 99839692
1-(2-hydroxyethyl)-3-[[2-(phenylmethoxymethyl)phenyl]methyl]urea
CID 110894223
N-[[2-(phenylmethoxymethyl)phenyl]methyl]-2-sulfamoylpropanamide
CID 154868821
2-amino-2-methyl-N-[[2-(phenylmethoxymethyl)phenyl]methyl]pentanamide;hydrochloride
CID 119718098
2-(N-ethylanilino)-N-prop-2-ynylacetamide
CID 78914189
2-(2-methylphenyl)-N-[[4-(phenylmethoxymethyl)phenyl]methyl]acetamide
CID 46464858
2,4,5-trimethyl-N-[[2-(phenylmethoxymethyl)phenyl]methyl]furan-3-carboxamide
CID 46456653

Frequently Asked Questions

What is the IUPAC name of 2-(N-ethylanilino)-N-[[2-(phenylmethoxymethyl)phenyl]methyl]acetamide?
The IUPAC name of 2-(N-ethylanilino)-N-[[2-(phenylmethoxymethyl)phenyl]methyl]acetamide (CID 60512306) is 2-(N-ethylanilino)-N-[[2-(phenylmethoxymethyl)phenyl]methyl]acetamide.
What is the SMILES notation for 2-(N-ethylanilino)-N-[[2-(phenylmethoxymethyl)phenyl]methyl]acetamide?
The canonical SMILES for 2-(N-ethylanilino)-N-[[2-(phenylmethoxymethyl)phenyl]methyl]acetamide is CCN(CC(=O)NCc1ccccc1COCc1ccccc1)c1ccccc1.
What is the InChIKey of 2-(N-ethylanilino)-N-[[2-(phenylmethoxymethyl)phenyl]methyl]acetamide?
The InChIKey is LXQHNHQPTPFPLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H28N2O2/c1-2-27(24-15-7-4-8-16-24)18-25(28)26-17-22-13-9-10-14-23(22)20-29-19-21-11-5-3-6-12-21/h3-16H,2,17-20H2,1H3,(H,26,28).
What are the key properties of 2-(N-ethylanilino)-N-[[2-(phenylmethoxymethyl)phenyl]methyl]acetamide?
2-(N-ethylanilino)-N-[[2-(phenylmethoxymethyl)phenyl]methyl]acetamide has a molecular weight of 388.51 g/mol, XLogP of 4.55, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-ethylanilino)-N-[[2-(phenylmethoxymethyl)phenyl]methyl]acetamide is sourced from PubChem (CID 60512306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).