2-[[2-(2-ethyl-6-methylanilino)-2-oxoethyl]amino]-2-phenylacetamide

C19H23N3O2 — CID 138015522

IUPAC2-[[2-(2-ethyl-6-methylanilino)-2-oxoethyl]amino]-2-phenylacetamide
SMILESCCc1cccc(C)c1NC(=O)CNC(C(N)=O)c1ccccc1
InChIInChI=1S/C19H23N3O2/c1-3-14-11-7-8-13(2)17(14)22-16(23)12-21-18(19(20)24)15-9-5-4-6-10-15/h4-11,18,21H,3,12H2,1-2H3,(H2,20,24)(H,22,23)
InChIKeyGXENUFCKXJPKQT-UHFFFAOYSA-N
MW325.41 g/mol
LogP2.31
Rot. Bonds7

About 2-[[2-(2-ethyl-6-methylanilino)-2-oxoethyl]amino]-2-phenylacetamide

2-[[2-(2-ethyl-6-methylanilino)-2-oxoethyl]amino]-2-phenylacetamide (PubChem CID 138015522) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is 2-[[2-(2-ethyl-6-methylanilino)-2-oxoethyl]amino]-2-phenylacetamide.

Molecular Properties

Compound Name2-[[2-(2-ethyl-6-methylanilino)-2-oxoethyl]amino]-2-phenylacetamide
PubChem CID138015522
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC Name2-[[2-(2-ethyl-6-methylanilino)-2-oxoethyl]amino]-2-phenylacetamide
SMILESCCc1cccc(C)c1NC(=O)CNC(C(N)=O)c1ccccc1
InChIInChI=1S/C19H23N3O2/c1-3-14-11-7-8-13(2)17(14)22-16(23)12-21-18(19(20)24)15-9-5-4-6-10-15/h4-11,18,21H,3,12H2,1-2H3,(H2,20,24)(H,22,23)
InChIKeyGXENUFCKXJPKQT-UHFFFAOYSA-N
XLogP2.31
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 52.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-(benzhydrylamino)-N-(2,6-diethylphenyl)acetamide
CID 2620925
(2R)-2-amino-N-(2-ethyl-6-methylphenyl)-2-phenylacetamide
CID 61148140
methyl 2-[(2-ethyl-6-methylphenyl)carbamoylamino]-2-phenylacetate
CID 3800080
(2S,3S)-2-[[2-(2-ethyl-6-methylanilino)-2-oxoethyl]amino]-3-methylpentanoic acid
CID 122099909
N-(2,6-diethylphenyl)-2-[[(1S)-2-methyl-1-phenylpropyl]amino]acetamide
CID 9131674
N-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]-2-phenylacetamide
CID 112997001
N'-(2-ethyl-6-methylphenyl)butanediamide
CID 82041304
2-[benzhydryl(ethyl)amino]-N-(2-ethyl-6-methylphenyl)acetamide
CID 154794872
[2-(2-ethyl-6-methylanilino)-2-oxoethyl]-[(S)-(4-methylphenyl)-phenylmethyl]azanium
CID 9391603
[2-(2-ethyl-6-methylanilino)-2-oxoethyl] (2S)-2-phenyl-2-phenylsulfanylacetate
CID 2389381
N-(2,6-dimethylphenyl)-2-(2-ethyl-6-methylanilino)acetamide
CID 33004349
N-(2,6-dimethylphenyl)-2-[(2-hydroxy-1-phenylethyl)amino]acetamide
CID 110012993

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(2-ethyl-6-methylanilino)-2-oxoethyl]amino]-2-phenylacetamide?
The IUPAC name of 2-[[2-(2-ethyl-6-methylanilino)-2-oxoethyl]amino]-2-phenylacetamide (CID 138015522) is 2-[[2-(2-ethyl-6-methylanilino)-2-oxoethyl]amino]-2-phenylacetamide.
What is the SMILES notation for 2-[[2-(2-ethyl-6-methylanilino)-2-oxoethyl]amino]-2-phenylacetamide?
The canonical SMILES for 2-[[2-(2-ethyl-6-methylanilino)-2-oxoethyl]amino]-2-phenylacetamide is CCc1cccc(C)c1NC(=O)CNC(C(N)=O)c1ccccc1.
What is the InChIKey of 2-[[2-(2-ethyl-6-methylanilino)-2-oxoethyl]amino]-2-phenylacetamide?
The InChIKey is GXENUFCKXJPKQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-3-14-11-7-8-13(2)17(14)22-16(23)12-21-18(19(20)24)15-9-5-4-6-10-15/h4-11,18,21H,3,12H2,1-2H3,(H2,20,24)(H,22,23).
What are the key properties of 2-[[2-(2-ethyl-6-methylanilino)-2-oxoethyl]amino]-2-phenylacetamide?
2-[[2-(2-ethyl-6-methylanilino)-2-oxoethyl]amino]-2-phenylacetamide has a molecular weight of 325.41 g/mol, XLogP of 2.31, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(2-ethyl-6-methylanilino)-2-oxoethyl]amino]-2-phenylacetamide is sourced from PubChem (CID 138015522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).