N-[2-(3-fluorophenyl)-2-methylpropyl]-2-hydroxy-2-methylpropanamide

C14H20FNO2 — CID 115179051

IUPACN-[2-(3-fluorophenyl)-2-methylpropyl]-2-hydroxy-2-methylpropanamide
SMILESCC(C)(O)C(=O)NCC(C)(C)c1cccc(F)c1
InChIInChI=1S/C14H20FNO2/c1-13(2,9-16-12(17)14(3,4)18)10-6-5-7-11(15)8-10/h5-8,18H,9H2,1-4H3,(H,16,17)
InChIKeyOZNHRIZDWCBKED-UHFFFAOYSA-N
MW253.32 g/mol
LogP1.99
Rot. Bonds4

About N-[2-(3-fluorophenyl)-2-methylpropyl]-2-hydroxy-2-methylpropanamide

N-[2-(3-fluorophenyl)-2-methylpropyl]-2-hydroxy-2-methylpropanamide (PubChem CID 115179051) has the molecular formula C14H20FNO2 and a molecular weight of 253.32 g/mol. Its IUPAC name is N-[2-(3-fluorophenyl)-2-methylpropyl]-2-hydroxy-2-methylpropanamide.

Molecular Properties

Compound NameN-[2-(3-fluorophenyl)-2-methylpropyl]-2-hydroxy-2-methylpropanamide
PubChem CID115179051
Molecular FormulaC14H20FNO2
Molecular Weight253.32 g/mol
Exact Mass253.15
IUPAC NameN-[2-(3-fluorophenyl)-2-methylpropyl]-2-hydroxy-2-methylpropanamide
SMILESCC(C)(O)C(=O)NCC(C)(C)c1cccc(F)c1
InChIInChI=1S/C14H20FNO2/c1-13(2,9-16-12(17)14(3,4)18)10-6-5-7-11(15)8-10/h5-8,18H,9H2,1-4H3,(H,16,17)
InChIKeyOZNHRIZDWCBKED-UHFFFAOYSA-N
XLogP1.99
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.32
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(3-fluorophenyl)-2-methylpropyl]carbamoyl bromide
CID 115194299
[2-(3-fluorophenyl)-2-methylpropyl]urea
CID 115168840
N-[2-(3-fluorophenyl)-2-methylpropyl]-2-(methylamino)acetamide
CID 115152192
2-hydroxy-2-methyl-N-(2-methyl-2-phenylpropyl)propanamide
CID 115179031
3-amino-N-[2-(3-fluorophenyl)-2-methylpropyl]butanamide
CID 115154464
N-[2-(3-fluorophenyl)-2-methylpropyl]azetidine-3-carboxamide
CID 115159147
N-[2-(3-fluorophenyl)-2-methylpropyl]-2-(hydroxymethyl)butanamide
CID 115186794
2-(4-aminophenyl)-N-[2-(3-fluorophenyl)-2-methylpropyl]acetamide
CID 119796104
7-amino-N-[2-(3-fluorophenyl)-2-methylpropyl]heptanamide
CID 119796098
(2S)-2-amino-N-[2-(3-fluorophenyl)-2-methylpropyl]-4-methylpentanamide;hydrochloride
CID 119796151
2-amino-N-[2-(3-fluorophenyl)-2-methylpropyl]-3-methoxypropanamide
CID 120990280
2-amino-2-(2-fluorophenyl)-N-[2-(3-fluorophenyl)-2-methylpropyl]acetamide
CID 166261259

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-fluorophenyl)-2-methylpropyl]-2-hydroxy-2-methylpropanamide?
The IUPAC name of N-[2-(3-fluorophenyl)-2-methylpropyl]-2-hydroxy-2-methylpropanamide (CID 115179051) is N-[2-(3-fluorophenyl)-2-methylpropyl]-2-hydroxy-2-methylpropanamide.
What is the SMILES notation for N-[2-(3-fluorophenyl)-2-methylpropyl]-2-hydroxy-2-methylpropanamide?
The canonical SMILES for N-[2-(3-fluorophenyl)-2-methylpropyl]-2-hydroxy-2-methylpropanamide is CC(C)(O)C(=O)NCC(C)(C)c1cccc(F)c1.
What is the InChIKey of N-[2-(3-fluorophenyl)-2-methylpropyl]-2-hydroxy-2-methylpropanamide?
The InChIKey is OZNHRIZDWCBKED-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO2/c1-13(2,9-16-12(17)14(3,4)18)10-6-5-7-11(15)8-10/h5-8,18H,9H2,1-4H3,(H,16,17).
What are the key properties of N-[2-(3-fluorophenyl)-2-methylpropyl]-2-hydroxy-2-methylpropanamide?
N-[2-(3-fluorophenyl)-2-methylpropyl]-2-hydroxy-2-methylpropanamide has a molecular weight of 253.32 g/mol, XLogP of 1.99, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-fluorophenyl)-2-methylpropyl]-2-hydroxy-2-methylpropanamide is sourced from PubChem (CID 115179051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).