N-[2-[[1-(4-ethylphenyl)-2-methylpropyl]amino]-2-oxoethyl]-2-phenylacetamide

C22H28N2O2 — CID 55437912

IUPACN-[2-[[1-(4-ethylphenyl)-2-methylpropyl]amino]-2-oxoethyl]-2-phenylacetamide
SMILESCCc1ccc(C(NC(=O)CNC(=O)Cc2ccccc2)C(C)C)cc1
InChIInChI=1S/C22H28N2O2/c1-4-17-10-12-19(13-11-17)22(16(2)3)24-21(26)15-23-20(25)14-18-8-6-5-7-9-18/h5-13,16,22H,4,14-15H2,1-3H3,(H,23,25)(H,24,26)
InChIKeyGHNNELQTPXCMJU-UHFFFAOYSA-N
MW352.48 g/mol
LogP3.42
Rot. Bonds8

About N-[2-[[1-(4-ethylphenyl)-2-methylpropyl]amino]-2-oxoethyl]-2-phenylacetamide

N-[2-[[1-(4-ethylphenyl)-2-methylpropyl]amino]-2-oxoethyl]-2-phenylacetamide (PubChem CID 55437912) has the molecular formula C22H28N2O2 and a molecular weight of 352.48 g/mol. Its IUPAC name is N-[2-[[1-(4-ethylphenyl)-2-methylpropyl]amino]-2-oxoethyl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[2-[[1-(4-ethylphenyl)-2-methylpropyl]amino]-2-oxoethyl]-2-phenylacetamide
PubChem CID55437912
Molecular FormulaC22H28N2O2
Molecular Weight352.48 g/mol
Exact Mass352.22
IUPAC NameN-[2-[[1-(4-ethylphenyl)-2-methylpropyl]amino]-2-oxoethyl]-2-phenylacetamide
SMILESCCc1ccc(C(NC(=O)CNC(=O)Cc2ccccc2)C(C)C)cc1
InChIInChI=1S/C22H28N2O2/c1-4-17-10-12-19(13-11-17)22(16(2)3)24-21(26)15-23-20(25)14-18-8-6-5-7-9-18/h5-13,16,22H,4,14-15H2,1-3H3,(H,23,25)(H,24,26)
InChIKeyGHNNELQTPXCMJU-UHFFFAOYSA-N
XLogP3.42
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.48
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

benzyl N-[2-[[1-(4-ethylphenyl)-2-methylpropyl]amino]-2-oxoethyl]carbamate
CID 60596157
N-benzyl-2-[[(1R)-1-(4-ethylphenyl)-2-methylpropyl]amino]acetamide
CID 8991910
N-[1-(4-ethylphenyl)ethyl]-2-phenylacetamide
CID 2854113
2-(butan-2-ylamino)-N-[1-(4-ethylphenyl)-2-methylpropyl]acetamide
CID 60684128
N-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]-2,2-diphenylacetamide
CID 7671231
N-[(1R)-2-methyl-1-phenylpropyl]-2-(4-phenylphenyl)acetamide
CID 2215611
N-[3-[[1-(4-ethylphenyl)-2-methylpropyl]amino]-3-oxopropyl]furan-2-carboxamide
CID 43031477
(2S)-3-methyl-2-[[2-[(2-phenylacetyl)amino]acetyl]amino]butanoic acid
CID 40551618
2-(3-benzyl-2,4,5-trioxoimidazolidin-1-yl)-N-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]acetamide
CID 9073243
N-[4-[[1-(4-ethylphenyl)-2-methylpropyl]amino]-4-oxobutyl]furan-2-carboxamide
CID 46532972
2-(4-methoxyphenyl)-N-(2-methyl-1-phenylpropyl)acetamide
CID 2964250
2-(4-methoxyphenyl)-N-[(1S)-2-methyl-1-phenylpropyl]acetamide
CID 974465

Frequently Asked Questions

What is the IUPAC name of N-[2-[[1-(4-ethylphenyl)-2-methylpropyl]amino]-2-oxoethyl]-2-phenylacetamide?
The IUPAC name of N-[2-[[1-(4-ethylphenyl)-2-methylpropyl]amino]-2-oxoethyl]-2-phenylacetamide (CID 55437912) is N-[2-[[1-(4-ethylphenyl)-2-methylpropyl]amino]-2-oxoethyl]-2-phenylacetamide.
What is the SMILES notation for N-[2-[[1-(4-ethylphenyl)-2-methylpropyl]amino]-2-oxoethyl]-2-phenylacetamide?
The canonical SMILES for N-[2-[[1-(4-ethylphenyl)-2-methylpropyl]amino]-2-oxoethyl]-2-phenylacetamide is CCc1ccc(C(NC(=O)CNC(=O)Cc2ccccc2)C(C)C)cc1.
What is the InChIKey of N-[2-[[1-(4-ethylphenyl)-2-methylpropyl]amino]-2-oxoethyl]-2-phenylacetamide?
The InChIKey is GHNNELQTPXCMJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O2/c1-4-17-10-12-19(13-11-17)22(16(2)3)24-21(26)15-23-20(25)14-18-8-6-5-7-9-18/h5-13,16,22H,4,14-15H2,1-3H3,(H,23,25)(H,24,26).
What are the key properties of N-[2-[[1-(4-ethylphenyl)-2-methylpropyl]amino]-2-oxoethyl]-2-phenylacetamide?
N-[2-[[1-(4-ethylphenyl)-2-methylpropyl]amino]-2-oxoethyl]-2-phenylacetamide has a molecular weight of 352.48 g/mol, XLogP of 3.42, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[[1-(4-ethylphenyl)-2-methylpropyl]amino]-2-oxoethyl]-2-phenylacetamide is sourced from PubChem (CID 55437912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).