2-amino-N-butan-2-yl-2-(4-methylphenyl)acetamide

C13H20N2O — CID 106151030

IUPAC2-amino-N-butan-2-yl-2-(4-methylphenyl)acetamide
SMILESCCC(C)NC(=O)C(N)c1ccc(C)cc1
InChIInChI=1S/C13H20N2O/c1-4-10(3)15-13(16)12(14)11-7-5-9(2)6-8-11/h5-8,10,12H,4,14H2,1-3H3,(H,15,16)
InChIKeyVRQFVSOTKBEJLG-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.91
Rot. Bonds4

About 2-amino-N-butan-2-yl-2-(4-methylphenyl)acetamide

2-amino-N-butan-2-yl-2-(4-methylphenyl)acetamide (PubChem CID 106151030) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 2-amino-N-butan-2-yl-2-(4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-amino-N-butan-2-yl-2-(4-methylphenyl)acetamide
PubChem CID106151030
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name2-amino-N-butan-2-yl-2-(4-methylphenyl)acetamide
SMILESCCC(C)NC(=O)C(N)c1ccc(C)cc1
InChIInChI=1S/C13H20N2O/c1-4-10(3)15-13(16)12(14)11-7-5-9(2)6-8-11/h5-8,10,12H,4,14H2,1-3H3,(H,15,16)
InChIKeyVRQFVSOTKBEJLG-UHFFFAOYSA-N
XLogP1.91
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-(5-methylhexan-2-yl)-2-(4-methylphenyl)acetamide
CID 106151106
2-amino-N-(1-ethylsulfanylpropan-2-yl)-2-(4-methylphenyl)acetamide
CID 114150574
2-amino-N-(3-methylpentan-2-yl)-2-(4-methylphenyl)acetamide;hydrochloride
CID 120667739
2-[[2-amino-2-(4-methylphenyl)acetyl]amino]-N-ethylpropanamide
CID 106151190
2-amino-2-(4-methylphenyl)-N-(1-methylsulfanylbutan-2-yl)acetamide
CID 106312729
2-amino-2-(4-methylphenyl)-N-pent-1-yn-3-ylacetamide
CID 106312995
2-amino-N-(4-hydroxy-4-phenylbutan-2-yl)-2-(4-methylphenyl)acetamide;hydrochloride
CID 120668952
2-amino-2-(4-methylphenyl)-N-(1-pyrazol-1-ylpropan-2-yl)acetamide;dihydrochloride
CID 120670649
2-amino-N-(1-cyanobutan-2-yl)-2-(4-methylphenyl)acetamide
CID 106312349
(2R)-2-amino-N-[(1R)-1-(4-methylphenyl)ethyl]-2-phenylacetamide
CID 81357033
3-[[2-amino-2-(4-methylphenyl)acetyl]amino]-2-methylbutanoic acid
CID 106312699
2-amino-2-(4-methylphenyl)-N-[1-[4-(trifluoromethyl)phenyl]propan-2-yl]acetamide
CID 120667536

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-butan-2-yl-2-(4-methylphenyl)acetamide?
The IUPAC name of 2-amino-N-butan-2-yl-2-(4-methylphenyl)acetamide (CID 106151030) is 2-amino-N-butan-2-yl-2-(4-methylphenyl)acetamide.
What is the SMILES notation for 2-amino-N-butan-2-yl-2-(4-methylphenyl)acetamide?
The canonical SMILES for 2-amino-N-butan-2-yl-2-(4-methylphenyl)acetamide is CCC(C)NC(=O)C(N)c1ccc(C)cc1.
What is the InChIKey of 2-amino-N-butan-2-yl-2-(4-methylphenyl)acetamide?
The InChIKey is VRQFVSOTKBEJLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-4-10(3)15-13(16)12(14)11-7-5-9(2)6-8-11/h5-8,10,12H,4,14H2,1-3H3,(H,15,16).
What are the key properties of 2-amino-N-butan-2-yl-2-(4-methylphenyl)acetamide?
2-amino-N-butan-2-yl-2-(4-methylphenyl)acetamide has a molecular weight of 220.32 g/mol, XLogP of 1.91, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-butan-2-yl-2-(4-methylphenyl)acetamide is sourced from PubChem (CID 106151030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).