N-ethyl-3-(3-fluorophenyl)-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide

C20H23FN2O3 — CID 38803128

IUPACN-ethyl-3-(3-fluorophenyl)-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide
SMILESCCN(CC(=O)Nc1ccccc1OC)C(=O)CCc1cccc(F)c1
InChIInChI=1S/C20H23FN2O3/c1-3-23(20(25)12-11-15-7-6-8-16(21)13-15)14-19(24)22-17-9-4-5-10-18(17)26-2/h4-10,13H,3,11-12,14H2,1-2H3,(H,22,24)
InChIKeyIPFJJGCREWHVMY-UHFFFAOYSA-N
MW358.41 g/mol
LogP3.25
Rot. Bonds8

About N-ethyl-3-(3-fluorophenyl)-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide

N-ethyl-3-(3-fluorophenyl)-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide (PubChem CID 38803128) has the molecular formula C20H23FN2O3 and a molecular weight of 358.41 g/mol. Its IUPAC name is N-ethyl-3-(3-fluorophenyl)-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide.

Molecular Properties

Compound NameN-ethyl-3-(3-fluorophenyl)-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide
PubChem CID38803128
Molecular FormulaC20H23FN2O3
Molecular Weight358.41 g/mol
Exact Mass358.17
IUPAC NameN-ethyl-3-(3-fluorophenyl)-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide
SMILESCCN(CC(=O)Nc1ccccc1OC)C(=O)CCc1cccc(F)c1
InChIInChI=1S/C20H23FN2O3/c1-3-23(20(25)12-11-15-7-6-8-16(21)13-15)14-19(24)22-17-9-4-5-10-18(17)26-2/h4-10,13H,3,11-12,14H2,1-2H3,(H,22,24)
InChIKeyIPFJJGCREWHVMY-UHFFFAOYSA-N
XLogP3.25
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.41
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-3-(4-ethylphenyl)-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide
CID 51184271
3-(4-chlorophenyl)-N-ethyl-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide
CID 38803115
1-ethyl-1-[(3-fluorophenyl)methyl]-3-(2-methoxyphenyl)urea
CID 24528941
N-ethyl-3-(1H-indol-3-yl)-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide
CID 26355956
N-ethyl-N-[2-(2-methoxyanilino)-2-oxoethyl]-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide
CID 46563230
N-(5-fluoro-2-methoxyphenyl)-2-(3-fluorophenyl)acetamide
CID 110776591
3-(3-fluorophenyl)-N-[(2-methoxyphenyl)methyl]-N-methylpropanamide
CID 78829784
2-bromo-5-fluoro-N-[2-(2-methoxyanilino)-2-oxoethyl]-N-propylbenzamide
CID 134008468
N-ethyl-3-methoxy-N-[2-(2-methoxyanilino)-2-oxoethyl]-4-methylbenzamide
CID 46563290
3-(3-fluorophenyl)-N-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]propanamide
CID 43052444
(2R)-2-amino-N-ethyl-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide;hydrochloride
CID 119267268
4-amino-N-[2-(2-methoxyanilino)-2-oxoethyl]-N-propylbutanamide
CID 119267716

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(3-fluorophenyl)-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide?
The IUPAC name of N-ethyl-3-(3-fluorophenyl)-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide (CID 38803128) is N-ethyl-3-(3-fluorophenyl)-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide.
What is the SMILES notation for N-ethyl-3-(3-fluorophenyl)-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide?
The canonical SMILES for N-ethyl-3-(3-fluorophenyl)-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide is CCN(CC(=O)Nc1ccccc1OC)C(=O)CCc1cccc(F)c1.
What is the InChIKey of N-ethyl-3-(3-fluorophenyl)-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide?
The InChIKey is IPFJJGCREWHVMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23FN2O3/c1-3-23(20(25)12-11-15-7-6-8-16(21)13-15)14-19(24)22-17-9-4-5-10-18(17)26-2/h4-10,13H,3,11-12,14H2,1-2H3,(H,22,24).
What are the key properties of N-ethyl-3-(3-fluorophenyl)-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide?
N-ethyl-3-(3-fluorophenyl)-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide has a molecular weight of 358.41 g/mol, XLogP of 3.25, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(3-fluorophenyl)-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide is sourced from PubChem (CID 38803128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).