2-(diethylamino)-N-[(2,5-dimethoxyphenyl)methyl]-2-phenylacetamide

C21H28N2O3 — CID 56540402

IUPAC2-(diethylamino)-N-[(2,5-dimethoxyphenyl)methyl]-2-phenylacetamide
SMILESCCN(CC)C(C(=O)NCc1cc(OC)ccc1OC)c1ccccc1
InChIInChI=1S/C21H28N2O3/c1-5-23(6-2)20(16-10-8-7-9-11-16)21(24)22-15-17-14-18(25-3)12-13-19(17)26-4/h7-14,20H,5-6,15H2,1-4H3,(H,22,24)
InChIKeyIERRNUUGWMRRNO-UHFFFAOYSA-N
MW356.47 g/mol
LogP3.40
Rot. Bonds9

About 2-(diethylamino)-N-[(2,5-dimethoxyphenyl)methyl]-2-phenylacetamide

2-(diethylamino)-N-[(2,5-dimethoxyphenyl)methyl]-2-phenylacetamide (PubChem CID 56540402) has the molecular formula C21H28N2O3 and a molecular weight of 356.47 g/mol. Its IUPAC name is 2-(diethylamino)-N-[(2,5-dimethoxyphenyl)methyl]-2-phenylacetamide.

Molecular Properties

Compound Name2-(diethylamino)-N-[(2,5-dimethoxyphenyl)methyl]-2-phenylacetamide
PubChem CID56540402
Molecular FormulaC21H28N2O3
Molecular Weight356.47 g/mol
Exact Mass356.21
IUPAC Name2-(diethylamino)-N-[(2,5-dimethoxyphenyl)methyl]-2-phenylacetamide
SMILESCCN(CC)C(C(=O)NCc1cc(OC)ccc1OC)c1ccccc1
InChIInChI=1S/C21H28N2O3/c1-5-23(6-2)20(16-10-8-7-9-11-16)21(24)22-15-17-14-18(25-3)12-13-19(17)26-4/h7-14,20H,5-6,15H2,1-4H3,(H,22,24)
InChIKeyIERRNUUGWMRRNO-UHFFFAOYSA-N
XLogP3.40
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.47
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(diethylamino)-N-[(3-methoxy-4-methylphenyl)methyl]-2-phenylacetamide
CID 56552650
2-(diethylamino)-N-[[2-(ethoxymethyl)phenyl]methyl]-2-phenylacetamide
CID 56540663
(2S)-2-amino-N-[(2,5-dimethoxyphenyl)methyl]butanamide;hydrochloride
CID 119278486
2-(diethylamino)-N-[2-(dimethylamino)-2-(2-methoxyphenyl)ethyl]-2-phenylacetamide
CID 56538316
N-[2-(2,5-dimethoxyphenyl)ethyl]-2,2-diphenylacetamide
CID 22742653
N-[(4-methoxyphenyl)methyl]-N-[2-[(2-methoxyphenyl)methylamino]-2-oxo-1-phenylethyl]butanamide
CID 133238737
(2R)-N-[(2-methoxyphenyl)methyl]-2-[methyl(methylsulfonyl)amino]-2-phenylacetamide
CID 100773773
N-[(2,5-dimethoxyphenyl)methyl]-1-phenylpropan-1-amine
CID 62050261
2-[[2-(3,4-dimethoxyphenyl)acetyl]-[(4-methoxyphenyl)methyl]amino]-N-[(4-methoxyphenyl)methyl]-2-phenylacetamide
CID 133238571
(2S)-2-(carbamoylamino)-N-[(2,5-dimethoxyphenyl)methyl]propanamide
CID 33101422
2-amino-N-[(2,5-dimethoxyphenyl)methyl]-2-(4-methylphenyl)acetamide;hydrochloride
CID 120666975
1-[(2,5-dimethoxyphenyl)methyl]-3-(2-propoxyphenyl)urea
CID 47032719

Frequently Asked Questions

What is the IUPAC name of 2-(diethylamino)-N-[(2,5-dimethoxyphenyl)methyl]-2-phenylacetamide?
The IUPAC name of 2-(diethylamino)-N-[(2,5-dimethoxyphenyl)methyl]-2-phenylacetamide (CID 56540402) is 2-(diethylamino)-N-[(2,5-dimethoxyphenyl)methyl]-2-phenylacetamide.
What is the SMILES notation for 2-(diethylamino)-N-[(2,5-dimethoxyphenyl)methyl]-2-phenylacetamide?
The canonical SMILES for 2-(diethylamino)-N-[(2,5-dimethoxyphenyl)methyl]-2-phenylacetamide is CCN(CC)C(C(=O)NCc1cc(OC)ccc1OC)c1ccccc1.
What is the InChIKey of 2-(diethylamino)-N-[(2,5-dimethoxyphenyl)methyl]-2-phenylacetamide?
The InChIKey is IERRNUUGWMRRNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H28N2O3/c1-5-23(6-2)20(16-10-8-7-9-11-16)21(24)22-15-17-14-18(25-3)12-13-19(17)26-4/h7-14,20H,5-6,15H2,1-4H3,(H,22,24).
What are the key properties of 2-(diethylamino)-N-[(2,5-dimethoxyphenyl)methyl]-2-phenylacetamide?
2-(diethylamino)-N-[(2,5-dimethoxyphenyl)methyl]-2-phenylacetamide has a molecular weight of 356.47 g/mol, XLogP of 3.40, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diethylamino)-N-[(2,5-dimethoxyphenyl)methyl]-2-phenylacetamide is sourced from PubChem (CID 56540402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).