N-ethyl-2-(3-fluorophenyl)-N-(2-hydroxyethyl)propanamide

C13H18FNO2 — CID 109468131

IUPACN-ethyl-2-(3-fluorophenyl)-N-(2-hydroxyethyl)propanamide
SMILESCCN(CCO)C(=O)C(C)c1cccc(F)c1
InChIInChI=1S/C13H18FNO2/c1-3-15(7-8-16)13(17)10(2)11-5-4-6-12(14)9-11/h4-6,9-10,16H,3,7-8H2,1-2H3
InChIKeySWCKJNOQHUHCNY-UHFFFAOYSA-N
MW239.29 g/mol
LogP1.77
Rot. Bonds5

About N-ethyl-2-(3-fluorophenyl)-N-(2-hydroxyethyl)propanamide

N-ethyl-2-(3-fluorophenyl)-N-(2-hydroxyethyl)propanamide (PubChem CID 109468131) has the molecular formula C13H18FNO2 and a molecular weight of 239.29 g/mol. Its IUPAC name is N-ethyl-2-(3-fluorophenyl)-N-(2-hydroxyethyl)propanamide.

Molecular Properties

Compound NameN-ethyl-2-(3-fluorophenyl)-N-(2-hydroxyethyl)propanamide
PubChem CID109468131
Molecular FormulaC13H18FNO2
Molecular Weight239.29 g/mol
Exact Mass239.13
IUPAC NameN-ethyl-2-(3-fluorophenyl)-N-(2-hydroxyethyl)propanamide
SMILESCCN(CCO)C(=O)C(C)c1cccc(F)c1
InChIInChI=1S/C13H18FNO2/c1-3-15(7-8-16)13(17)10(2)11-5-4-6-12(14)9-11/h4-6,9-10,16H,3,7-8H2,1-2H3
InChIKeySWCKJNOQHUHCNY-UHFFFAOYSA-N
XLogP1.77
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.29
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-ethyl-2-(3-fluorophenyl)-N-(2-hydroxyethyl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(3-fluorophenyl)-N-(2-hydroxyethyl)-N-(2-phenylethyl)propanamide
CID 111477587
2-(3-aminophenyl)-N-ethyl-N-(2-ethylbutyl)propanamide
CID 106590949
2-[2-(3-fluorophenyl)propanoyl-propan-2-ylamino]acetic acid
CID 119198714
3-amino-N-ethyl-N-(2-hydroxyethyl)-2-methyl-3-phenylpropanamide
CID 80552105
N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-(3-nitrophenyl)propanamide
CID 107483075
2-(3-fluorophenyl)-N-piperidin-4-yl-N-propylpropanamide
CID 119823341
3-[ethyl-[3-(3-fluorophenyl)butanoyl]amino]propanoic acid
CID 119190914
N-ethyl-3-(3-fluorophenyl)-N-(2-hydroxyethyl)-2-(5-methyltetrazol-1-yl)propanamide
CID 110893922
2-amino-N-ethyl-N-(2-hydroxyethyl)-2-phenylacetamide;hydrochloride
CID 110897047
(2S)-N,N-diethyl-2-(3-pyrimidin-2-ylphenyl)propanamide
CID 139148668
2-[[2-amino-1-(3-fluorophenyl)propyl]-propylamino]ethanol
CID 55020152
3-cyano-N,N-diethyl-3-(3-fluorophenyl)propanamide
CID 82139134

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(3-fluorophenyl)-N-(2-hydroxyethyl)propanamide?
The IUPAC name of N-ethyl-2-(3-fluorophenyl)-N-(2-hydroxyethyl)propanamide (CID 109468131) is N-ethyl-2-(3-fluorophenyl)-N-(2-hydroxyethyl)propanamide.
What is the SMILES notation for N-ethyl-2-(3-fluorophenyl)-N-(2-hydroxyethyl)propanamide?
The canonical SMILES for N-ethyl-2-(3-fluorophenyl)-N-(2-hydroxyethyl)propanamide is CCN(CCO)C(=O)C(C)c1cccc(F)c1.
What is the InChIKey of N-ethyl-2-(3-fluorophenyl)-N-(2-hydroxyethyl)propanamide?
The InChIKey is SWCKJNOQHUHCNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18FNO2/c1-3-15(7-8-16)13(17)10(2)11-5-4-6-12(14)9-11/h4-6,9-10,16H,3,7-8H2,1-2H3.
What are the key properties of N-ethyl-2-(3-fluorophenyl)-N-(2-hydroxyethyl)propanamide?
N-ethyl-2-(3-fluorophenyl)-N-(2-hydroxyethyl)propanamide has a molecular weight of 239.29 g/mol, XLogP of 1.77, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(3-fluorophenyl)-N-(2-hydroxyethyl)propanamide is sourced from PubChem (CID 109468131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).