N-(2-acetamidoethyl)-2-methyl-2-phenylpropanamide

C14H20N2O2 — CID 110678562

IUPACN-(2-acetamidoethyl)-2-methyl-2-phenylpropanamide
SMILESCC(=O)NCCNC(=O)C(C)(C)c1ccccc1
InChIInChI=1S/C14H20N2O2/c1-11(17)15-9-10-16-13(18)14(2,3)12-7-5-4-6-8-12/h4-8H,9-10H2,1-3H3,(H,15,17)(H,16,18)
InChIKeyHIPUOQLKBCMOCY-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.22
Rot. Bonds5

About N-(2-acetamidoethyl)-2-methyl-2-phenylpropanamide

N-(2-acetamidoethyl)-2-methyl-2-phenylpropanamide (PubChem CID 110678562) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N-(2-acetamidoethyl)-2-methyl-2-phenylpropanamide.

Molecular Properties

Compound NameN-(2-acetamidoethyl)-2-methyl-2-phenylpropanamide
PubChem CID110678562
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC NameN-(2-acetamidoethyl)-2-methyl-2-phenylpropanamide
SMILESCC(=O)NCCNC(=O)C(C)(C)c1ccccc1
InChIInChI=1S/C14H20N2O2/c1-11(17)15-9-10-16-13(18)14(2,3)12-7-5-4-6-8-12/h4-8H,9-10H2,1-3H3,(H,15,17)(H,16,18)
InChIKeyHIPUOQLKBCMOCY-UHFFFAOYSA-N
XLogP1.22
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-methyl-2-phenyl-N-[2-(propan-2-ylamino)ethyl]propanamide
CID 62659574
N-(2-acetamidoethyl)-2-(4-methoxyphenyl)-2-methylpropanamide
CID 110437825
N-(4-bromobutyl)-2-methyl-2-phenylpropanamide
CID 106845643
2-methyl-N-(2-methylprop-2-enyl)-2-phenylpropanamide
CID 114618287
2-methyl-N-[2-(2-methylphenyl)ethyl]-2-phenylpropanamide
CID 46531773
N-(3,3-dimethyl-2-oxobutyl)-2-methyl-2-phenylpropanamide
CID 64991414
N-(2-hydroxy-2-methylbutyl)-2-methyl-2-phenylpropanamide
CID 65114444
N-(4-azidobutyl)-2-methyl-2-phenylpropanamide
CID 114182177
N-[3-[benzyl(methyl)amino]propyl]-2-methyl-2-phenylpropanamide
CID 46532557
2-methyl-2-phenyl-N-(3,3,3-trifluoro-2-hydroxypropyl)propanamide
CID 103730656
2-(4-fluorophenyl)-2-methyl-N-(2-phenylethyl)propanamide
CID 113197365
N-[2-[(2-amino-2-phenylpropanoyl)amino]ethyl]-2,2-dimethylpropanamide
CID 120591033

Frequently Asked Questions

What is the IUPAC name of N-(2-acetamidoethyl)-2-methyl-2-phenylpropanamide?
The IUPAC name of N-(2-acetamidoethyl)-2-methyl-2-phenylpropanamide (CID 110678562) is N-(2-acetamidoethyl)-2-methyl-2-phenylpropanamide.
What is the SMILES notation for N-(2-acetamidoethyl)-2-methyl-2-phenylpropanamide?
The canonical SMILES for N-(2-acetamidoethyl)-2-methyl-2-phenylpropanamide is CC(=O)NCCNC(=O)C(C)(C)c1ccccc1.
What is the InChIKey of N-(2-acetamidoethyl)-2-methyl-2-phenylpropanamide?
The InChIKey is HIPUOQLKBCMOCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-11(17)15-9-10-16-13(18)14(2,3)12-7-5-4-6-8-12/h4-8H,9-10H2,1-3H3,(H,15,17)(H,16,18).
What are the key properties of N-(2-acetamidoethyl)-2-methyl-2-phenylpropanamide?
N-(2-acetamidoethyl)-2-methyl-2-phenylpropanamide has a molecular weight of 248.33 g/mol, XLogP of 1.22, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-acetamidoethyl)-2-methyl-2-phenylpropanamide is sourced from PubChem (CID 110678562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).