(2S)-N,N-diethyl-2-[[2-(4-methoxyphenyl)acetyl]amino]-2-phenylacetamide

C21H26N2O3 — CID 110287094

IUPAC(2S)-N,N-diethyl-2-[[2-(4-methoxyphenyl)acetyl]amino]-2-phenylacetamide
SMILESCCN(CC)C(=O)[C@@H](NC(=O)Cc1ccc(OC)cc1)c1ccccc1
InChIInChI=1S/C21H26N2O3/c1-4-23(5-2)21(25)20(17-9-7-6-8-10-17)22-19(24)15-16-11-13-18(26-3)14-12-16/h6-14,20H,4-5,15H2,1-3H3,(H,22,24)/t20-/m0/s1
InChIKeyDJDXTFFISWOLOR-FQEVSTJZSA-N
MW354.45 g/mol
LogP2.96
Rot. Bonds8

About (2S)-N,N-diethyl-2-[[2-(4-methoxyphenyl)acetyl]amino]-2-phenylacetamide

(2S)-N,N-diethyl-2-[[2-(4-methoxyphenyl)acetyl]amino]-2-phenylacetamide (PubChem CID 110287094) has the molecular formula C21H26N2O3 and a molecular weight of 354.45 g/mol. Its IUPAC name is (2S)-N,N-diethyl-2-[[2-(4-methoxyphenyl)acetyl]amino]-2-phenylacetamide.

Molecular Properties

Compound Name(2S)-N,N-diethyl-2-[[2-(4-methoxyphenyl)acetyl]amino]-2-phenylacetamide
PubChem CID110287094
Molecular FormulaC21H26N2O3
Molecular Weight354.45 g/mol
Exact Mass354.19
IUPAC Name(2S)-N,N-diethyl-2-[[2-(4-methoxyphenyl)acetyl]amino]-2-phenylacetamide
SMILESCCN(CC)C(=O)[C@@H](NC(=O)Cc1ccc(OC)cc1)c1ccccc1
InChIInChI=1S/C21H26N2O3/c1-4-23(5-2)21(25)20(17-9-7-6-8-10-17)22-19(24)15-16-11-13-18(26-3)14-12-16/h6-14,20H,4-5,15H2,1-3H3,(H,22,24)/t20-/m0/s1
InChIKeyDJDXTFFISWOLOR-FQEVSTJZSA-N
XLogP2.96
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.45
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1S)-2-(diethylamino)-2-oxo-1-phenylethyl]butanamide
CID 110287066
N-[(1S)-2-(diethylamino)-2-oxo-1-phenylethyl]-2-methylpropanamide
CID 110287067
N-(2-chloro-1-phenylethyl)-2-(4-methoxyphenyl)acetamide
CID 114300105
2-(4-methoxyphenyl)-N-(2-methyl-1-phenylpropyl)acetamide
CID 2964250
2-(4-methoxyphenyl)-N-[(1S)-2-methyl-1-phenylpropyl]acetamide
CID 974465
N-[2-(dimethylamino)-2-phenylethyl]-2-(4-methoxyphenyl)acetamide
CID 45001416
ethyl 2-[[(1S)-2-(diethylamino)-2-oxo-1-phenylethyl]amino]-2-oxoacetate
CID 110287113
2-(4-methoxyphenyl)-N-[phenyl-(4-phenylphenyl)methyl]acetamide
CID 2964251
N-[(1R)-1-(4-methoxyphenyl)propyl]-2-phenylacetamide
CID 28632525
(2S)-N,N-diethyl-2-phenyl-2-(phenylcarbamoylamino)acetamide
CID 110287102
2-(4-methoxyphenyl)-N-[phenyl(pyridin-2-yl)methyl]acetamide
CID 42907688
methyl (2S)-2-[[2-(4-methoxyphenyl)acetyl]amino]-2-(4-methylphenyl)acetate
CID 95783989

Frequently Asked Questions

What is the IUPAC name of (2S)-N,N-diethyl-2-[[2-(4-methoxyphenyl)acetyl]amino]-2-phenylacetamide?
The IUPAC name of (2S)-N,N-diethyl-2-[[2-(4-methoxyphenyl)acetyl]amino]-2-phenylacetamide (CID 110287094) is (2S)-N,N-diethyl-2-[[2-(4-methoxyphenyl)acetyl]amino]-2-phenylacetamide.
What is the SMILES notation for (2S)-N,N-diethyl-2-[[2-(4-methoxyphenyl)acetyl]amino]-2-phenylacetamide?
The canonical SMILES for (2S)-N,N-diethyl-2-[[2-(4-methoxyphenyl)acetyl]amino]-2-phenylacetamide is CCN(CC)C(=O)[C@@H](NC(=O)Cc1ccc(OC)cc1)c1ccccc1.
What is the InChIKey of (2S)-N,N-diethyl-2-[[2-(4-methoxyphenyl)acetyl]amino]-2-phenylacetamide?
The InChIKey is DJDXTFFISWOLOR-FQEVSTJZSA-N. The full InChI is InChI=1S/C21H26N2O3/c1-4-23(5-2)21(25)20(17-9-7-6-8-10-17)22-19(24)15-16-11-13-18(26-3)14-12-16/h6-14,20H,4-5,15H2,1-3H3,(H,22,24)/t20-/m0/s1.
What are the key properties of (2S)-N,N-diethyl-2-[[2-(4-methoxyphenyl)acetyl]amino]-2-phenylacetamide?
(2S)-N,N-diethyl-2-[[2-(4-methoxyphenyl)acetyl]amino]-2-phenylacetamide has a molecular weight of 354.45 g/mol, XLogP of 2.96, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N,N-diethyl-2-[[2-(4-methoxyphenyl)acetyl]amino]-2-phenylacetamide is sourced from PubChem (CID 110287094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).