N-[2-[acetyl(2-phenylethyl)amino]ethyl]-3-fluorobenzamide

C19H21FN2O2 — CID 113055543

IUPACN-[2-[acetyl(2-phenylethyl)amino]ethyl]-3-fluorobenzamide
SMILESCC(=O)N(CCNC(=O)c1cccc(F)c1)CCc1ccccc1
InChIInChI=1S/C19H21FN2O2/c1-15(23)22(12-10-16-6-3-2-4-7-16)13-11-21-19(24)17-8-5-9-18(20)14-17/h2-9,14H,10-13H2,1H3,(H,21,24)
InChIKeyNJSROPUQTNKDKF-UHFFFAOYSA-N
MW328.39 g/mol
LogP2.65
Rot. Bonds7

About N-[2-[acetyl(2-phenylethyl)amino]ethyl]-3-fluorobenzamide

N-[2-[acetyl(2-phenylethyl)amino]ethyl]-3-fluorobenzamide (PubChem CID 113055543) has the molecular formula C19H21FN2O2 and a molecular weight of 328.39 g/mol. Its IUPAC name is N-[2-[acetyl(2-phenylethyl)amino]ethyl]-3-fluorobenzamide.

Molecular Properties

Compound NameN-[2-[acetyl(2-phenylethyl)amino]ethyl]-3-fluorobenzamide
PubChem CID113055543
Molecular FormulaC19H21FN2O2
Molecular Weight328.39 g/mol
Exact Mass328.16
IUPAC NameN-[2-[acetyl(2-phenylethyl)amino]ethyl]-3-fluorobenzamide
SMILESCC(=O)N(CCNC(=O)c1cccc(F)c1)CCc1ccccc1
InChIInChI=1S/C19H21FN2O2/c1-15(23)22(12-10-16-6-3-2-4-7-16)13-11-21-19(24)17-8-5-9-18(20)14-17/h2-9,14H,10-13H2,1H3,(H,21,24)
InChIKeyNJSROPUQTNKDKF-UHFFFAOYSA-N
XLogP2.65
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.39
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[2-[acetyl(2-phenylethyl)amino]ethyl]-3-fluorobenzamide 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-[acetyl-[2-(3-chlorophenyl)ethyl]amino]ethyl]-3-fluorobenzamide
CID 113057065
N-[2-[acetyl(pyridin-2-ylmethyl)amino]ethyl]-3-fluorobenzamide
CID 113055172
N-[2-[acetyl-[2-(4-methoxyphenyl)ethyl]amino]ethyl]benzamide
CID 113055959
N-[2-[acetyl(2-phenylethyl)amino]ethyl]-4-methoxybenzamide
CID 113055550
N-[2-[acetyl(2-phenylethyl)amino]ethyl]-2-bromobenzamide
CID 113055545
N-[2-[acetyl-[2-(4-chlorophenyl)ethyl]amino]ethyl]-3,4-difluorobenzamide
CID 113056272
N-[2-[acetyl-[2-(3-methoxyphenyl)ethyl]amino]ethyl]-3-methylbenzamide
CID 113055892
N-[2-[acetyl(3-phenylpropyl)amino]ethyl]-2,3,4-trifluorobenzamide
CID 113056455
N-[2-[acetyl-[2-(4-fluorophenyl)ethyl]amino]ethyl]-4-(trifluoromethyl)benzamide
CID 113055767
N-[2-[acetyl(3-phenylpropyl)amino]ethyl]-3,4-dimethoxybenzamide
CID 113056437
N-[2-[acetyl-[2-(dimethylamino)ethyl]amino]ethyl]-2-(3-fluorophenyl)acetamide
CID 113053567
N-[2-(N-acetyl-2-chloroanilino)ethyl]-3-fluorobenzamide
CID 113059416

Frequently Asked Questions

What is the IUPAC name of N-[2-[acetyl(2-phenylethyl)amino]ethyl]-3-fluorobenzamide?
The IUPAC name of N-[2-[acetyl(2-phenylethyl)amino]ethyl]-3-fluorobenzamide (CID 113055543) is N-[2-[acetyl(2-phenylethyl)amino]ethyl]-3-fluorobenzamide.
What is the SMILES notation for N-[2-[acetyl(2-phenylethyl)amino]ethyl]-3-fluorobenzamide?
The canonical SMILES for N-[2-[acetyl(2-phenylethyl)amino]ethyl]-3-fluorobenzamide is CC(=O)N(CCNC(=O)c1cccc(F)c1)CCc1ccccc1.
What is the InChIKey of N-[2-[acetyl(2-phenylethyl)amino]ethyl]-3-fluorobenzamide?
The InChIKey is NJSROPUQTNKDKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FN2O2/c1-15(23)22(12-10-16-6-3-2-4-7-16)13-11-21-19(24)17-8-5-9-18(20)14-17/h2-9,14H,10-13H2,1H3,(H,21,24).
What are the key properties of N-[2-[acetyl(2-phenylethyl)amino]ethyl]-3-fluorobenzamide?
N-[2-[acetyl(2-phenylethyl)amino]ethyl]-3-fluorobenzamide has a molecular weight of 328.39 g/mol, XLogP of 2.65, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[acetyl(2-phenylethyl)amino]ethyl]-3-fluorobenzamide is sourced from PubChem (CID 113055543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).