N-[3-(dimethylamino)-1-(4-fluorophenyl)propyl]-4-ethylbenzamide

C20H25FN2O — CID 110281892

IUPACN-[3-(dimethylamino)-1-(4-fluorophenyl)propyl]-4-ethylbenzamide
SMILESCCc1ccc(C(=O)NC(CCN(C)C)c2ccc(F)cc2)cc1
InChIInChI=1S/C20H25FN2O/c1-4-15-5-7-17(8-6-15)20(24)22-19(13-14-23(2)3)16-9-11-18(21)12-10-16/h5-12,19H,4,13-14H2,1-3H3,(H,22,24)
InChIKeyDXTAIMCHKKYDKY-UHFFFAOYSA-N
MW328.43 g/mol
LogP3.81
Rot. Bonds7

About N-[3-(dimethylamino)-1-(4-fluorophenyl)propyl]-4-ethylbenzamide

N-[3-(dimethylamino)-1-(4-fluorophenyl)propyl]-4-ethylbenzamide (PubChem CID 110281892) has the molecular formula C20H25FN2O and a molecular weight of 328.43 g/mol. Its IUPAC name is N-[3-(dimethylamino)-1-(4-fluorophenyl)propyl]-4-ethylbenzamide.

Molecular Properties

Compound NameN-[3-(dimethylamino)-1-(4-fluorophenyl)propyl]-4-ethylbenzamide
PubChem CID110281892
Molecular FormulaC20H25FN2O
Molecular Weight328.43 g/mol
Exact Mass328.20
IUPAC NameN-[3-(dimethylamino)-1-(4-fluorophenyl)propyl]-4-ethylbenzamide
SMILESCCc1ccc(C(=O)NC(CCN(C)C)c2ccc(F)cc2)cc1
InChIInChI=1S/C20H25FN2O/c1-4-15-5-7-17(8-6-15)20(24)22-19(13-14-23(2)3)16-9-11-18(21)12-10-16/h5-12,19H,4,13-14H2,1-3H3,(H,22,24)
InChIKeyDXTAIMCHKKYDKY-UHFFFAOYSA-N
XLogP3.81
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.43
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[3-(dimethylamino)-1-(4-fluorophenyl)propyl]-4-ethylbenzamide 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-[3-(dimethylamino)-1-(4-fluorophenyl)propyl]-4-ethoxybenzamide
CID 110281864
N-[3-(dimethylamino)-1-(4-fluorophenyl)propyl]-4-(pyrazol-1-ylmethyl)benzamide
CID 110281662
N-[3-(dimethylamino)-1-(4-fluorophenyl)propyl]-4-propan-2-yloxybenzamide
CID 110281894
N-[3-(dimethylamino)-1-(4-fluorophenyl)propyl]-4-nitrobenzamide
CID 110281831
4-[(4-chloro-3,5-dimethylpyrazol-1-yl)methyl]-N-[3-(dimethylamino)-1-(4-fluorophenyl)propyl]benzamide
CID 110281659
N-[3-(dimethylamino)-1-(4-fluorophenyl)propyl]-2-ethylbutanamide
CID 110281896
N-[3-(dimethylamino)-1-(4-fluorophenyl)propyl]-3-methylthiophene-2-carboxamide
CID 110281862
N-[3-(dimethylamino)-1-(4-fluorophenyl)propyl]-1,2,3-trimethylindole-5-carboxamide
CID 110281594
N-[(1S)-3-(dimethylamino)-1-(4-methylphenyl)propyl]-4-phenylbenzamide
CID 24954832
4-fluoro-N-(1-phenylbutyl)benzamide
CID 60657146
N-[3-(dimethylamino)-1-(4-fluorophenyl)propyl]-2,5-dimethylfuran-3-carboxamide
CID 110281854
4-bromo-N-[2-(dimethylamino)-1-(4-fluorophenyl)ethyl]benzamide
CID 155947722

Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylamino)-1-(4-fluorophenyl)propyl]-4-ethylbenzamide?
The IUPAC name of N-[3-(dimethylamino)-1-(4-fluorophenyl)propyl]-4-ethylbenzamide (CID 110281892) is N-[3-(dimethylamino)-1-(4-fluorophenyl)propyl]-4-ethylbenzamide.
What is the SMILES notation for N-[3-(dimethylamino)-1-(4-fluorophenyl)propyl]-4-ethylbenzamide?
The canonical SMILES for N-[3-(dimethylamino)-1-(4-fluorophenyl)propyl]-4-ethylbenzamide is CCc1ccc(C(=O)NC(CCN(C)C)c2ccc(F)cc2)cc1.
What is the InChIKey of N-[3-(dimethylamino)-1-(4-fluorophenyl)propyl]-4-ethylbenzamide?
The InChIKey is DXTAIMCHKKYDKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25FN2O/c1-4-15-5-7-17(8-6-15)20(24)22-19(13-14-23(2)3)16-9-11-18(21)12-10-16/h5-12,19H,4,13-14H2,1-3H3,(H,22,24).
What are the key properties of N-[3-(dimethylamino)-1-(4-fluorophenyl)propyl]-4-ethylbenzamide?
N-[3-(dimethylamino)-1-(4-fluorophenyl)propyl]-4-ethylbenzamide has a molecular weight of 328.43 g/mol, XLogP of 3.81, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylamino)-1-(4-fluorophenyl)propyl]-4-ethylbenzamide is sourced from PubChem (CID 110281892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).