2-amino-N-[2-(tert-butylamino)-2-oxoethyl]-N-methyl-2-(4-methylphenyl)acetamide

C16H25N3O2 — CID 106151195

IUPAC2-amino-N-[2-(tert-butylamino)-2-oxoethyl]-N-methyl-2-(4-methylphenyl)acetamide
SMILESCc1ccc(C(N)C(=O)N(C)CC(=O)NC(C)(C)C)cc1
InChIInChI=1S/C16H25N3O2/c1-11-6-8-12(9-7-11)14(17)15(21)19(5)10-13(20)18-16(2,3)4/h6-9,14H,10,17H2,1-5H3,(H,18,20)
InChIKeyOBTCEUPMLCEVBW-UHFFFAOYSA-N
MW291.39 g/mol
LogP1.37
Rot. Bonds4

About 2-amino-N-[2-(tert-butylamino)-2-oxoethyl]-N-methyl-2-(4-methylphenyl)acetamide

2-amino-N-[2-(tert-butylamino)-2-oxoethyl]-N-methyl-2-(4-methylphenyl)acetamide (PubChem CID 106151195) has the molecular formula C16H25N3O2 and a molecular weight of 291.39 g/mol. Its IUPAC name is 2-amino-N-[2-(tert-butylamino)-2-oxoethyl]-N-methyl-2-(4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-amino-N-[2-(tert-butylamino)-2-oxoethyl]-N-methyl-2-(4-methylphenyl)acetamide
PubChem CID106151195
Molecular FormulaC16H25N3O2
Molecular Weight291.39 g/mol
Exact Mass291.19
IUPAC Name2-amino-N-[2-(tert-butylamino)-2-oxoethyl]-N-methyl-2-(4-methylphenyl)acetamide
SMILESCc1ccc(C(N)C(=O)N(C)CC(=O)NC(C)(C)C)cc1
InChIInChI=1S/C16H25N3O2/c1-11-6-8-12(9-7-11)14(17)15(21)19(5)10-13(20)18-16(2,3)4/h6-9,14H,10,17H2,1-5H3,(H,18,20)
InChIKeyOBTCEUPMLCEVBW-UHFFFAOYSA-N
XLogP1.37
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[2-(ethylamino)-2-oxoethyl]-N-methyl-2-(4-methylphenyl)acetamide
CID 106151379
2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methyl-2-(4-methylphenyl)acetamide
CID 106151192
2-amino-N-methyl-2-(4-methylphenyl)-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]acetamide
CID 120667422
2-amino-N-methyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-2-(4-methylphenyl)acetamide
CID 120666888
2-amino-N-methyl-2-(4-methylphenyl)-N-propylacetamide
CID 106151263
(2S)-2-[[2-(tert-butylamino)-2-oxoethyl]-methylamino]-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]propanamide
CID 8768055
2-amino-N-methyl-N-(2-methylbutyl)-2-(4-methylphenyl)acetamide
CID 106151480
2-amino-N-methyl-2-(4-methylphenyl)-N-pentylacetamide
CID 106312073
N-tert-butyl-2-[[N-ethyl-N'-[2-hydroxy-2-(4-methylphenyl)ethyl]carbamimidoyl]-methylamino]acetamide;hydroiodide
CID 111378831
2-amino-N-methyl-N-(2-methylbutyl)-2-(4-methylphenyl)acetamide;hydrochloride
CID 120668393
2-amino-N-methyl-2-(4-methylphenyl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide
CID 120667405
(2R)-N-[2-(tert-butylamino)-2-oxoethyl]-2-chloro-N-methylpropanamide
CID 93317901

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(tert-butylamino)-2-oxoethyl]-N-methyl-2-(4-methylphenyl)acetamide?
The IUPAC name of 2-amino-N-[2-(tert-butylamino)-2-oxoethyl]-N-methyl-2-(4-methylphenyl)acetamide (CID 106151195) is 2-amino-N-[2-(tert-butylamino)-2-oxoethyl]-N-methyl-2-(4-methylphenyl)acetamide.
What is the SMILES notation for 2-amino-N-[2-(tert-butylamino)-2-oxoethyl]-N-methyl-2-(4-methylphenyl)acetamide?
The canonical SMILES for 2-amino-N-[2-(tert-butylamino)-2-oxoethyl]-N-methyl-2-(4-methylphenyl)acetamide is Cc1ccc(C(N)C(=O)N(C)CC(=O)NC(C)(C)C)cc1.
What is the InChIKey of 2-amino-N-[2-(tert-butylamino)-2-oxoethyl]-N-methyl-2-(4-methylphenyl)acetamide?
The InChIKey is OBTCEUPMLCEVBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O2/c1-11-6-8-12(9-7-11)14(17)15(21)19(5)10-13(20)18-16(2,3)4/h6-9,14H,10,17H2,1-5H3,(H,18,20).
What are the key properties of 2-amino-N-[2-(tert-butylamino)-2-oxoethyl]-N-methyl-2-(4-methylphenyl)acetamide?
2-amino-N-[2-(tert-butylamino)-2-oxoethyl]-N-methyl-2-(4-methylphenyl)acetamide has a molecular weight of 291.39 g/mol, XLogP of 1.37, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(tert-butylamino)-2-oxoethyl]-N-methyl-2-(4-methylphenyl)acetamide is sourced from PubChem (CID 106151195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).