N-[2-[4-(dimethylamino)phenyl]ethyl]-3-(2-fluorophenyl)propanamide

C19H23FN2O — CID 110627058

IUPACN-[2-[4-(dimethylamino)phenyl]ethyl]-3-(2-fluorophenyl)propanamide
SMILESCN(C)c1ccc(CCNC(=O)CCc2ccccc2F)cc1
InChIInChI=1S/C19H23FN2O/c1-22(2)17-10-7-15(8-11-17)13-14-21-19(23)12-9-16-5-3-4-6-18(16)20/h3-8,10-11H,9,12-14H2,1-2H3,(H,21,23)
InChIKeyYWQLUYJXIOSBLL-UHFFFAOYSA-N
MW314.40 g/mol
LogP3.18
Rot. Bonds7

About N-[2-[4-(dimethylamino)phenyl]ethyl]-3-(2-fluorophenyl)propanamide

N-[2-[4-(dimethylamino)phenyl]ethyl]-3-(2-fluorophenyl)propanamide (PubChem CID 110627058) has the molecular formula C19H23FN2O and a molecular weight of 314.40 g/mol. Its IUPAC name is N-[2-[4-(dimethylamino)phenyl]ethyl]-3-(2-fluorophenyl)propanamide.

Molecular Properties

Compound NameN-[2-[4-(dimethylamino)phenyl]ethyl]-3-(2-fluorophenyl)propanamide
PubChem CID110627058
Molecular FormulaC19H23FN2O
Molecular Weight314.40 g/mol
Exact Mass314.18
IUPAC NameN-[2-[4-(dimethylamino)phenyl]ethyl]-3-(2-fluorophenyl)propanamide
SMILESCN(C)c1ccc(CCNC(=O)CCc2ccccc2F)cc1
InChIInChI=1S/C19H23FN2O/c1-22(2)17-10-7-15(8-11-17)13-14-21-19(23)12-9-16-5-3-4-6-18(16)20/h3-8,10-11H,9,12-14H2,1-2H3,(H,21,23)
InChIKeyYWQLUYJXIOSBLL-UHFFFAOYSA-N
XLogP3.18
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.40
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

Analyze N-[2-[4-(dimethylamino)phenyl]ethyl]-3-(2-fluorophenyl)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

N-[2-[4-(dimethylamino)phenyl]ethyl]-3-phenylpropanamide
CID 16889411
N-[2-[4-(dimethylamino)phenyl]ethyl]-3-(2-fluorophenyl)-2-methylpropanamide
CID 110307160
1-[[4-(dimethylamino)phenyl]methyl]-3-[2-(2-fluorophenyl)ethyl]urea
CID 38949164
N-[2-[4-(dimethylamino)phenyl]ethyl]-3-(4-methoxyphenyl)propanamide
CID 16889384
(2S)-2-(dimethylamino)-N-[2-[4-(dimethylamino)phenyl]ethyl]-2-(2-fluorophenyl)acetamide
CID 97139155
N-[2-(4-fluorophenyl)ethyl]-3-[2-(2-fluorophenyl)ethylamino]propanamide
CID 109024783
1-[2-[4-(dimethylamino)phenyl]ethyl]-3-[(2-fluorophenyl)methyl]-2-methylguanidine
CID 111266859
N'-[2-(2-fluorophenyl)ethyl]-N-(2-phenylethyl)propanediamide
CID 108947912
3-(2-fluorophenyl)-N-pentylpropanamide
CID 94133753
N-[2-[4-(dimethylamino)phenyl]ethyl]-1-(2-fluorophenyl)methanesulfonamide
CID 16890483
3-[3-[4-(dimethylamino)phenyl]propanoylamino]propanoic acid
CID 43354679
1-[2-[4-(dimethylamino)phenyl]ethyl]-3-ethyl-2-[(2-fluorophenyl)methyl]guanidine
CID 111265331

Frequently Asked Questions

What is the IUPAC name of N-[2-[4-(dimethylamino)phenyl]ethyl]-3-(2-fluorophenyl)propanamide?
The IUPAC name of N-[2-[4-(dimethylamino)phenyl]ethyl]-3-(2-fluorophenyl)propanamide (CID 110627058) is N-[2-[4-(dimethylamino)phenyl]ethyl]-3-(2-fluorophenyl)propanamide.
What is the SMILES notation for N-[2-[4-(dimethylamino)phenyl]ethyl]-3-(2-fluorophenyl)propanamide?
The canonical SMILES for N-[2-[4-(dimethylamino)phenyl]ethyl]-3-(2-fluorophenyl)propanamide is CN(C)c1ccc(CCNC(=O)CCc2ccccc2F)cc1.
What is the InChIKey of N-[2-[4-(dimethylamino)phenyl]ethyl]-3-(2-fluorophenyl)propanamide?
The InChIKey is YWQLUYJXIOSBLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23FN2O/c1-22(2)17-10-7-15(8-11-17)13-14-21-19(23)12-9-16-5-3-4-6-18(16)20/h3-8,10-11H,9,12-14H2,1-2H3,(H,21,23).
What are the key properties of N-[2-[4-(dimethylamino)phenyl]ethyl]-3-(2-fluorophenyl)propanamide?
N-[2-[4-(dimethylamino)phenyl]ethyl]-3-(2-fluorophenyl)propanamide has a molecular weight of 314.40 g/mol, XLogP of 3.18, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-(dimethylamino)phenyl]ethyl]-3-(2-fluorophenyl)propanamide is sourced from PubChem (CID 110627058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).