2-amino-2-methyl-N-(2-phenylethyl)butanamide

C13H20N2O — CID 73062281

IUPAC2-amino-2-methyl-N-(2-phenylethyl)butanamide
SMILESCCC(C)(N)C(=O)NCCc1ccccc1
InChIInChI=1S/C13H20N2O/c1-3-13(2,14)12(16)15-10-9-11-7-5-4-6-8-11/h4-8H,3,9-10,14H2,1-2H3,(H,15,16)
InChIKeyWJOYHVKLTGCHBH-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.47
Rot. Bonds5

About 2-amino-2-methyl-N-(2-phenylethyl)butanamide

2-amino-2-methyl-N-(2-phenylethyl)butanamide (PubChem CID 73062281) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 2-amino-2-methyl-N-(2-phenylethyl)butanamide.

Molecular Properties

Compound Name2-amino-2-methyl-N-(2-phenylethyl)butanamide
PubChem CID73062281
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name2-amino-2-methyl-N-(2-phenylethyl)butanamide
SMILESCCC(C)(N)C(=O)NCCc1ccccc1
InChIInChI=1S/C13H20N2O/c1-3-13(2,14)12(16)15-10-9-11-7-5-4-6-8-11/h4-8H,3,9-10,14H2,1-2H3,(H,15,16)
InChIKeyWJOYHVKLTGCHBH-UHFFFAOYSA-N
XLogP1.47
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-[2-(3-methoxyphenyl)ethyl]-2-methylbutanamide
CID 107842874
2-hydroxy-2-methyl-N-(2-phenylethyl)propanamide
CID 71525164
2,2-diethyl-N'-(2-phenylethyl)propanediamide
CID 70140992
2-amino-2-methyl-N-(3-phenylpropyl)pentanamide;hydrochloride
CID 119674817
3-amino-2,2,3-trimethyl-N-(3-phenylpropyl)butanamide
CID 65269650
2-amino-N-[2-(4-fluorophenyl)ethyl]-2-methylpentanamide
CID 60847510
2-amino-N-[2-(1H-indol-3-yl)ethyl]-2-methylbutanamide
CID 79805542
2-amino-2-methyl-N-(5-phenylpentyl)propanamide
CID 119317062
N-[2-(4-chlorophenyl)ethyl]-2,2-dimethyl-N'-(2-phenylethyl)propanediamide
CID 108963810
2,2-dimethyl-N-(3-methylbutyl)-N'-(2-phenylethyl)propanediamide
CID 108963827
2-amino-2-methyl-N-(5-phenylpentyl)propanamide;hydrochloride
CID 119317061
2-amino-N-[2-oxo-2-(2-phenylethylamino)ethyl]-2-phenylpropanamide;hydrochloride
CID 120590847

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-methyl-N-(2-phenylethyl)butanamide?
The IUPAC name of 2-amino-2-methyl-N-(2-phenylethyl)butanamide (CID 73062281) is 2-amino-2-methyl-N-(2-phenylethyl)butanamide.
What is the SMILES notation for 2-amino-2-methyl-N-(2-phenylethyl)butanamide?
The canonical SMILES for 2-amino-2-methyl-N-(2-phenylethyl)butanamide is CCC(C)(N)C(=O)NCCc1ccccc1.
What is the InChIKey of 2-amino-2-methyl-N-(2-phenylethyl)butanamide?
The InChIKey is WJOYHVKLTGCHBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-3-13(2,14)12(16)15-10-9-11-7-5-4-6-8-11/h4-8H,3,9-10,14H2,1-2H3,(H,15,16).
What are the key properties of 2-amino-2-methyl-N-(2-phenylethyl)butanamide?
2-amino-2-methyl-N-(2-phenylethyl)butanamide has a molecular weight of 220.32 g/mol, XLogP of 1.47, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-methyl-N-(2-phenylethyl)butanamide is sourced from PubChem (CID 73062281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).