2,2-dimethyl-N-(1-phenylethyl)propanamide

C13H19NO — CID 4252554

IUPAC2,2-dimethyl-N-(1-phenylethyl)propanamide
SMILESCC(NC(=O)C(C)(C)C)c1ccccc1
InChIInChI=1S/C13H19NO/c1-10(11-8-6-5-7-9-11)14-12(15)13(2,3)4/h5-10H,1-4H3,(H,14,15)
InChIKeyHBBKPRZFGXDWHG-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.91
Rot. Bonds2

About 2,2-dimethyl-N-(1-phenylethyl)propanamide

2,2-dimethyl-N-(1-phenylethyl)propanamide (PubChem CID 4252554) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 2,2-dimethyl-N-(1-phenylethyl)propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-(1-phenylethyl)propanamide
PubChem CID4252554
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name2,2-dimethyl-N-(1-phenylethyl)propanamide
SMILESCC(NC(=O)C(C)(C)C)c1ccccc1
InChIInChI=1S/C13H19NO/c1-10(11-8-6-5-7-9-11)14-12(15)13(2,3)4/h5-10H,1-4H3,(H,14,15)
InChIKeyHBBKPRZFGXDWHG-UHFFFAOYSA-N
XLogP2.91
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-bromo-2-methyl-N-(1-phenylethyl)propanamide
CID 82109308
2,2-diphenyl-N-(1-phenylethyl)propanamide
CID 2939416
3-amino-2,2,3-trimethyl-N-(1-phenylethyl)butanamide
CID 65264623
2,2-dimethyl-N-(1-phenylethyl)-N'-propan-2-ylpropanediamide
CID 108957197
3-chloro-2,2-dimethyl-N-(1-phenylethyl)propanamide
CID 63681272
3-amino-2,2-dimethyl-N-[(1S)-1-phenylethyl]propanamide
CID 115426736
2,2-dimethyl-N-[1-oxo-3-phenyl-1-(1-phenylethylamino)propan-2-yl]propanamide
CID 59684320
N-[(1R,2R)-1-hydroxy-1-phenylpropan-2-yl]-2,2-dimethylpropanamide
CID 15210216
2,2,3,3,3-pentafluoro-N-[(1S)-1-phenylethyl]propanamide
CID 14877204
2,2,3,3,3-pentafluoro-N-(1-phenylethyl)propanamide
CID 4153379
2,2-dimethyl-N-(1-pyridin-3-ylethyl)propanamide
CID 60717480
N-[1-(4-methoxyphenyl)ethyl]-2,2-dimethylpropanamide
CID 17330111

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-(1-phenylethyl)propanamide?
The IUPAC name of 2,2-dimethyl-N-(1-phenylethyl)propanamide (CID 4252554) is 2,2-dimethyl-N-(1-phenylethyl)propanamide.
What is the SMILES notation for 2,2-dimethyl-N-(1-phenylethyl)propanamide?
The canonical SMILES for 2,2-dimethyl-N-(1-phenylethyl)propanamide is CC(NC(=O)C(C)(C)C)c1ccccc1.
What is the InChIKey of 2,2-dimethyl-N-(1-phenylethyl)propanamide?
The InChIKey is HBBKPRZFGXDWHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-10(11-8-6-5-7-9-11)14-12(15)13(2,3)4/h5-10H,1-4H3,(H,14,15).
What are the key properties of 2,2-dimethyl-N-(1-phenylethyl)propanamide?
2,2-dimethyl-N-(1-phenylethyl)propanamide has a molecular weight of 205.30 g/mol, XLogP of 2.91, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-(1-phenylethyl)propanamide is sourced from PubChem (CID 4252554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).