N-ethyl-N-(4-fluorophenyl)-2-hydroxy-2-methylpropanamide

C12H16FNO2 — CID 103429881

IUPACN-ethyl-N-(4-fluorophenyl)-2-hydroxy-2-methylpropanamide
SMILESCCN(C(=O)C(C)(C)O)c1ccc(F)cc1
InChIInChI=1S/C12H16FNO2/c1-4-14(11(15)12(2,3)16)10-7-5-9(13)6-8-10/h5-8,16H,4H2,1-3H3
InChIKeyOVKZOERBHGJBKO-UHFFFAOYSA-N
MW225.26 g/mol
LogP1.95
Rot. Bonds3

About N-ethyl-N-(4-fluorophenyl)-2-hydroxy-2-methylpropanamide

N-ethyl-N-(4-fluorophenyl)-2-hydroxy-2-methylpropanamide (PubChem CID 103429881) has the molecular formula C12H16FNO2 and a molecular weight of 225.26 g/mol. Its IUPAC name is N-ethyl-N-(4-fluorophenyl)-2-hydroxy-2-methylpropanamide.

Molecular Properties

Compound NameN-ethyl-N-(4-fluorophenyl)-2-hydroxy-2-methylpropanamide
PubChem CID103429881
Molecular FormulaC12H16FNO2
Molecular Weight225.26 g/mol
Exact Mass225.12
IUPAC NameN-ethyl-N-(4-fluorophenyl)-2-hydroxy-2-methylpropanamide
SMILESCCN(C(=O)C(C)(C)O)c1ccc(F)cc1
InChIInChI=1S/C12H16FNO2/c1-4-14(11(15)12(2,3)16)10-7-5-9(13)6-8-10/h5-8,16H,4H2,1-3H3
InChIKeyOVKZOERBHGJBKO-UHFFFAOYSA-N
XLogP1.95
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.26
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-2-(ethylamino)-N-(4-fluorophenyl)-2-methylpropanamide
CID 55121871
2-cyano-N-ethyl-N-(4-fluorophenyl)-2-methylbutanamide
CID 114291393
N-ethyl-N-(4-fluorophenyl)-3,3-dimethylbutanamide
CID 78806080
3-chloro-1-ethyl-1-(4-fluorophenyl)urea
CID 87646855
N-ethyl-2,2-dimethyl-N-[4-(trifluoromethyl)phenyl]propanamide
CID 176738854
(2S)-2-amino-N-ethyl-N-(4-fluorophenyl)propanamide;hydrochloride
CID 119271831
N-ethyl-N-(4-fluorophenyl)hexanamide
CID 78806862
4-[[ethyl-(4-fluorophenyl)carbamoyl]amino]-4-methylpentanoic acid
CID 62048002
N-ethyl-2,2-dimethyl-N-phenylpropanamide
CID 4127582
N-ethyl-N-(4-fluorophenyl)cyclobutanecarboxamide
CID 39964862
2-[(3-amino-2,2-dimethylpropyl)-methylamino]-N-ethyl-N-(4-fluorophenyl)acetamide
CID 79646551
N-ethyl-N-(4-fluorophenyl)-4-hydroxypentanamide
CID 79192647

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(4-fluorophenyl)-2-hydroxy-2-methylpropanamide?
The IUPAC name of N-ethyl-N-(4-fluorophenyl)-2-hydroxy-2-methylpropanamide (CID 103429881) is N-ethyl-N-(4-fluorophenyl)-2-hydroxy-2-methylpropanamide.
What is the SMILES notation for N-ethyl-N-(4-fluorophenyl)-2-hydroxy-2-methylpropanamide?
The canonical SMILES for N-ethyl-N-(4-fluorophenyl)-2-hydroxy-2-methylpropanamide is CCN(C(=O)C(C)(C)O)c1ccc(F)cc1.
What is the InChIKey of N-ethyl-N-(4-fluorophenyl)-2-hydroxy-2-methylpropanamide?
The InChIKey is OVKZOERBHGJBKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FNO2/c1-4-14(11(15)12(2,3)16)10-7-5-9(13)6-8-10/h5-8,16H,4H2,1-3H3.
What are the key properties of N-ethyl-N-(4-fluorophenyl)-2-hydroxy-2-methylpropanamide?
N-ethyl-N-(4-fluorophenyl)-2-hydroxy-2-methylpropanamide has a molecular weight of 225.26 g/mol, XLogP of 1.95, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(4-fluorophenyl)-2-hydroxy-2-methylpropanamide is sourced from PubChem (CID 103429881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).