N-(2-hydroxy-2-methylbutyl)-2-methyl-2-phenylpropanamide

C15H23NO2 — CID 65114444

IUPACN-(2-hydroxy-2-methylbutyl)-2-methyl-2-phenylpropanamide
SMILESCCC(C)(O)CNC(=O)C(C)(C)c1ccccc1
InChIInChI=1S/C15H23NO2/c1-5-15(4,18)11-16-13(17)14(2,3)12-9-7-6-8-10-12/h6-10,18H,5,11H2,1-4H3,(H,16,17)
InChIKeyYDWQAFHKLIPXMG-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.24
Rot. Bonds5

About N-(2-hydroxy-2-methylbutyl)-2-methyl-2-phenylpropanamide

N-(2-hydroxy-2-methylbutyl)-2-methyl-2-phenylpropanamide (PubChem CID 65114444) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is N-(2-hydroxy-2-methylbutyl)-2-methyl-2-phenylpropanamide.

Molecular Properties

Compound NameN-(2-hydroxy-2-methylbutyl)-2-methyl-2-phenylpropanamide
PubChem CID65114444
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC NameN-(2-hydroxy-2-methylbutyl)-2-methyl-2-phenylpropanamide
SMILESCCC(C)(O)CNC(=O)C(C)(C)c1ccccc1
InChIInChI=1S/C15H23NO2/c1-5-15(4,18)11-16-13(17)14(2,3)12-9-7-6-8-10-12/h6-10,18H,5,11H2,1-4H3,(H,16,17)
InChIKeyYDWQAFHKLIPXMG-UHFFFAOYSA-N
XLogP2.24
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(aminomethyl)-2-ethylbutyl]-2-methyl-2-phenylpropanamide
CID 106250793
1-[(2S)-2-hydroxy-2-methylbutyl]-3-phenylurea
CID 94797729
N-(2-acetamidoethyl)-2-methyl-2-phenylpropanamide
CID 110678562
N-(3,3-dimethyl-2-oxobutyl)-2-methyl-2-phenylpropanamide
CID 64991414
phenyl N-(2-hydroxy-2-methylbutyl)carbamate
CID 65110904
N-[2-hydroxy-2-(5-methylfuran-2-yl)propyl]-2-methyl-2-phenylpropanamide
CID 71985002
2-methyl-N-(2-methylprop-2-enyl)-2-phenylpropanamide
CID 114618287
2-hydroxy-2-methyl-N-(2-methyl-2-phenylpropyl)propanamide
CID 115179031
N-(2-hydroxy-2-methylbutyl)-2-phenoxyacetamide
CID 65114465
N-(2-amino-2-methylpropyl)-2-ethyl-2-phenylbutanamide;hydrochloride
CID 119627567
2-methyl-2-phenyl-N-(3,3,3-trifluoro-2-hydroxypropyl)propanamide
CID 103730656
N-(4-bromobutyl)-2-methyl-2-phenylpropanamide
CID 106845643

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-2-methylbutyl)-2-methyl-2-phenylpropanamide?
The IUPAC name of N-(2-hydroxy-2-methylbutyl)-2-methyl-2-phenylpropanamide (CID 65114444) is N-(2-hydroxy-2-methylbutyl)-2-methyl-2-phenylpropanamide.
What is the SMILES notation for N-(2-hydroxy-2-methylbutyl)-2-methyl-2-phenylpropanamide?
The canonical SMILES for N-(2-hydroxy-2-methylbutyl)-2-methyl-2-phenylpropanamide is CCC(C)(O)CNC(=O)C(C)(C)c1ccccc1.
What is the InChIKey of N-(2-hydroxy-2-methylbutyl)-2-methyl-2-phenylpropanamide?
The InChIKey is YDWQAFHKLIPXMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-5-15(4,18)11-16-13(17)14(2,3)12-9-7-6-8-10-12/h6-10,18H,5,11H2,1-4H3,(H,16,17).
What are the key properties of N-(2-hydroxy-2-methylbutyl)-2-methyl-2-phenylpropanamide?
N-(2-hydroxy-2-methylbutyl)-2-methyl-2-phenylpropanamide has a molecular weight of 249.35 g/mol, XLogP of 2.24, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-2-methylbutyl)-2-methyl-2-phenylpropanamide is sourced from PubChem (CID 65114444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).