N-[2-(2-ethylimidazol-1-yl)ethyl]-2-(4-fluorophenyl)benzamide

C20H20FN3O — CID 91785685

IUPACN-[2-(2-ethylimidazol-1-yl)ethyl]-2-(4-fluorophenyl)benzamide
SMILESCCc1nccn1CCNC(=O)c1ccccc1-c1ccc(F)cc1
InChIInChI=1S/C20H20FN3O/c1-2-19-22-11-13-24(19)14-12-23-20(25)18-6-4-3-5-17(18)15-7-9-16(21)10-8-15/h3-11,13H,2,12,14H2,1H3,(H,23,25)
InChIKeyZIVIANONQKECJJ-UHFFFAOYSA-N
MW337.40 g/mol
LogP3.68
Rot. Bonds6

About N-[2-(2-ethylimidazol-1-yl)ethyl]-2-(4-fluorophenyl)benzamide

N-[2-(2-ethylimidazol-1-yl)ethyl]-2-(4-fluorophenyl)benzamide (PubChem CID 91785685) has the molecular formula C20H20FN3O and a molecular weight of 337.40 g/mol. Its IUPAC name is N-[2-(2-ethylimidazol-1-yl)ethyl]-2-(4-fluorophenyl)benzamide.

Molecular Properties

Compound NameN-[2-(2-ethylimidazol-1-yl)ethyl]-2-(4-fluorophenyl)benzamide
PubChem CID91785685
Molecular FormulaC20H20FN3O
Molecular Weight337.40 g/mol
Exact Mass337.16
IUPAC NameN-[2-(2-ethylimidazol-1-yl)ethyl]-2-(4-fluorophenyl)benzamide
SMILESCCc1nccn1CCNC(=O)c1ccccc1-c1ccc(F)cc1
InChIInChI=1S/C20H20FN3O/c1-2-19-22-11-13-24(19)14-12-23-20(25)18-6-4-3-5-17(18)15-7-9-16(21)10-8-15/h3-11,13H,2,12,14H2,1H3,(H,23,25)
InChIKeyZIVIANONQKECJJ-UHFFFAOYSA-N
XLogP3.68
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.40
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[2-(2-ethylimidazol-1-yl)ethyl]-2-(4-fluorophenyl)benzamide 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

5-(2-chlorophenyl)-N-[2-(2-ethylimidazol-1-yl)ethyl]furan-2-carboxamide
CID 70717961
N-[2-(2-ethylimidazol-1-yl)ethyl]-2,3-dioxo-1,4-dihydroquinoxaline-6-carboxamide
CID 91759660
2-fluoro-N-[2-(1-methylimidazol-2-yl)ethyl]benzamide
CID 61215487
3-(4-fluorophenyl)-1-methyl-N-[2-(2-oxopyrimidin-1-yl)ethyl]pyrazole-5-carboxamide
CID 131703935
N-[2-(2-ethylimidazol-1-yl)ethyl]-2-pyrrolidin-1-ylacetamide
CID 91793772
N-[[1-[(2-ethylimidazol-1-yl)methyl]cyclopropyl]methyl]-2-(1H-imidazol-2-yl)benzamide
CID 91833630
N-[2-(2-ethylimidazol-1-yl)ethyl]-2,7,8-trimethylquinoline-4-carboxamide
CID 70712385
N-[2-[4-(4-fluorophenyl)-6-oxopyrimidin-1-yl]ethyl]-2-(4-methylbenzoyl)benzamide
CID 90516055
5-[3-(2-ethylimidazol-1-yl)propylamino]-3-(4-fluorophenyl)-5-oxopentanoic acid
CID 91953107
4-[2-(2-ethylimidazol-1-yl)ethyl]-N-(4-fluorophenyl)piperazine-1-carboxamide
CID 90561851
N-[3-(2-ethylimidazol-1-yl)propyl]furan-2-carboxamide
CID 13371088
N-butyl-2-phenylbenzamide
CID 21064565

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-ethylimidazol-1-yl)ethyl]-2-(4-fluorophenyl)benzamide?
The IUPAC name of N-[2-(2-ethylimidazol-1-yl)ethyl]-2-(4-fluorophenyl)benzamide (CID 91785685) is N-[2-(2-ethylimidazol-1-yl)ethyl]-2-(4-fluorophenyl)benzamide.
What is the SMILES notation for N-[2-(2-ethylimidazol-1-yl)ethyl]-2-(4-fluorophenyl)benzamide?
The canonical SMILES for N-[2-(2-ethylimidazol-1-yl)ethyl]-2-(4-fluorophenyl)benzamide is CCc1nccn1CCNC(=O)c1ccccc1-c1ccc(F)cc1.
What is the InChIKey of N-[2-(2-ethylimidazol-1-yl)ethyl]-2-(4-fluorophenyl)benzamide?
The InChIKey is ZIVIANONQKECJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20FN3O/c1-2-19-22-11-13-24(19)14-12-23-20(25)18-6-4-3-5-17(18)15-7-9-16(21)10-8-15/h3-11,13H,2,12,14H2,1H3,(H,23,25).
What are the key properties of N-[2-(2-ethylimidazol-1-yl)ethyl]-2-(4-fluorophenyl)benzamide?
N-[2-(2-ethylimidazol-1-yl)ethyl]-2-(4-fluorophenyl)benzamide has a molecular weight of 337.40 g/mol, XLogP of 3.68, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-ethylimidazol-1-yl)ethyl]-2-(4-fluorophenyl)benzamide is sourced from PubChem (CID 91785685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).