2-[(2-amino-2-oxoethyl)-[2-oxo-2-(4-propan-2-ylphenyl)ethyl]amino]acetamide

C15H21N3O3 — CID 62923142

IUPAC2-[(2-amino-2-oxoethyl)-[2-oxo-2-(4-propan-2-ylphenyl)ethyl]amino]acetamide
SMILESCC(C)c1ccc(C(=O)CN(CC(N)=O)CC(N)=O)cc1
InChIInChI=1S/C15H21N3O3/c1-10(2)11-3-5-12(6-4-11)13(19)7-18(8-14(16)20)9-15(17)21/h3-6,10H,7-9H2,1-2H3,(H2,16,20)(H2,17,21)
InChIKeyKHAUTCQBSUVRPX-UHFFFAOYSA-N
MW291.35 g/mol
LogP0.27
Rot. Bonds8

About 2-[(2-amino-2-oxoethyl)-[2-oxo-2-(4-propan-2-ylphenyl)ethyl]amino]acetamide

2-[(2-amino-2-oxoethyl)-[2-oxo-2-(4-propan-2-ylphenyl)ethyl]amino]acetamide (PubChem CID 62923142) has the molecular formula C15H21N3O3 and a molecular weight of 291.35 g/mol. Its IUPAC name is 2-[(2-amino-2-oxoethyl)-[2-oxo-2-(4-propan-2-ylphenyl)ethyl]amino]acetamide.

Molecular Properties

Compound Name2-[(2-amino-2-oxoethyl)-[2-oxo-2-(4-propan-2-ylphenyl)ethyl]amino]acetamide
PubChem CID62923142
Molecular FormulaC15H21N3O3
Molecular Weight291.35 g/mol
Exact Mass291.16
IUPAC Name2-[(2-amino-2-oxoethyl)-[2-oxo-2-(4-propan-2-ylphenyl)ethyl]amino]acetamide
SMILESCC(C)c1ccc(C(=O)CN(CC(N)=O)CC(N)=O)cc1
InChIInChI=1S/C15H21N3O3/c1-10(2)11-3-5-12(6-4-11)13(19)7-18(8-14(16)20)9-15(17)21/h3-6,10H,7-9H2,1-2H3,(H2,16,20)(H2,17,21)
InChIKeyKHAUTCQBSUVRPX-UHFFFAOYSA-N
XLogP0.27
TPSA106.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 50.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(2-amino-2-oxoethyl)-[2-(4-bromophenyl)-2-oxoethyl]amino]acetamide
CID 62922079
6-oxo-6-(4-propan-2-ylphenyl)hexanamide
CID 174637388
1,4-bis(4-propan-2-ylphenyl)butane-1,4-dione
CID 166515280
2-[ethyl(propan-2-yl)amino]-1-(4-propan-2-ylphenyl)ethanone
CID 43795097
2-[[2-(4-methoxyphenyl)-2-oxoethyl]-(2-methylpropyl)amino]acetamide
CID 62035280
2-[3-(dimethylamino)propyl-ethylamino]-1-(4-propan-2-ylphenyl)ethanone
CID 102995078
2-[1-hydroxypropan-2-yl(methyl)amino]-1-(4-propan-2-ylphenyl)ethanone
CID 104552733
2-[2-hydroxyethyl(propan-2-yl)amino]-1-(4-propan-2-ylphenyl)ethanone
CID 62030140
3-[methyl-[2-oxo-2-(4-propan-2-ylphenyl)ethyl]amino]propanoic acid
CID 82136248
1,5-bis(4-propan-2-ylphenyl)pentane-1,5-dione
CID 23512927
2-(N,4-dimethylanilino)-1-(4-propan-2-ylphenyl)ethanone
CID 63567372
(2-amino-2-oxoethyl) 4-propan-2-ylbenzoate
CID 2505465

Frequently Asked Questions

What is the IUPAC name of 2-[(2-amino-2-oxoethyl)-[2-oxo-2-(4-propan-2-ylphenyl)ethyl]amino]acetamide?
The IUPAC name of 2-[(2-amino-2-oxoethyl)-[2-oxo-2-(4-propan-2-ylphenyl)ethyl]amino]acetamide (CID 62923142) is 2-[(2-amino-2-oxoethyl)-[2-oxo-2-(4-propan-2-ylphenyl)ethyl]amino]acetamide.
What is the SMILES notation for 2-[(2-amino-2-oxoethyl)-[2-oxo-2-(4-propan-2-ylphenyl)ethyl]amino]acetamide?
The canonical SMILES for 2-[(2-amino-2-oxoethyl)-[2-oxo-2-(4-propan-2-ylphenyl)ethyl]amino]acetamide is CC(C)c1ccc(C(=O)CN(CC(N)=O)CC(N)=O)cc1.
What is the InChIKey of 2-[(2-amino-2-oxoethyl)-[2-oxo-2-(4-propan-2-ylphenyl)ethyl]amino]acetamide?
The InChIKey is KHAUTCQBSUVRPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O3/c1-10(2)11-3-5-12(6-4-11)13(19)7-18(8-14(16)20)9-15(17)21/h3-6,10H,7-9H2,1-2H3,(H2,16,20)(H2,17,21).
What are the key properties of 2-[(2-amino-2-oxoethyl)-[2-oxo-2-(4-propan-2-ylphenyl)ethyl]amino]acetamide?
2-[(2-amino-2-oxoethyl)-[2-oxo-2-(4-propan-2-ylphenyl)ethyl]amino]acetamide has a molecular weight of 291.35 g/mol, XLogP of 0.27, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-amino-2-oxoethyl)-[2-oxo-2-(4-propan-2-ylphenyl)ethyl]amino]acetamide is sourced from PubChem (CID 62923142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).