2-[2-(4-fluorophenyl)morpholin-4-yl]-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide

C24H30FN3O3 — CID 112826133

IUPAC2-[2-(4-fluorophenyl)morpholin-4-yl]-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide
SMILESCCCN(CC(=O)Nc1ccccc1C)C(=O)CN1CCOC(c2ccc(F)cc2)C1
InChIInChI=1S/C24H30FN3O3/c1-3-12-28(16-23(29)26-21-7-5-4-6-18(21)2)24(30)17-27-13-14-31-22(15-27)19-8-10-20(25)11-9-19/h4-11,22H,3,12-17H2,1-2H3,(H,26,29)
InChIKeyIMVHGXQWQZWNMN-UHFFFAOYSA-N
MW427.52 g/mol
LogP3.38
Rot. Bonds8

About 2-[2-(4-fluorophenyl)morpholin-4-yl]-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide

2-[2-(4-fluorophenyl)morpholin-4-yl]-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide (PubChem CID 112826133) has the molecular formula C24H30FN3O3 and a molecular weight of 427.52 g/mol. Its IUPAC name is 2-[2-(4-fluorophenyl)morpholin-4-yl]-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide.

Molecular Properties

Compound Name2-[2-(4-fluorophenyl)morpholin-4-yl]-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide
PubChem CID112826133
Molecular FormulaC24H30FN3O3
Molecular Weight427.52 g/mol
Exact Mass427.23
IUPAC Name2-[2-(4-fluorophenyl)morpholin-4-yl]-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide
SMILESCCCN(CC(=O)Nc1ccccc1C)C(=O)CN1CCOC(c2ccc(F)cc2)C1
InChIInChI=1S/C24H30FN3O3/c1-3-12-28(16-23(29)26-21-7-5-4-6-18(21)2)24(30)17-27-13-14-31-22(15-27)19-8-10-20(25)11-9-19/h4-11,22H,3,12-17H2,1-2H3,(H,26,29)
InChIKeyIMVHGXQWQZWNMN-UHFFFAOYSA-N
XLogP3.38
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500427.52
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[2-(4-fluorophenyl)morpholin-4-yl]-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide 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-(2-methylanilino)-2-oxoethyl]-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]-N-propylacetamide
CID 112840661
2-[2-(4-fluorophenyl)morpholin-4-yl]-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 55566155
N-(2-cyanoethyl)-N-ethyl-2-[2-(4-fluorophenyl)morpholin-4-yl]acetamide
CID 119041162
N-(2-fluorophenyl)-3-[2-(4-fluorophenyl)morpholin-4-yl]propanamide
CID 43065711
N-(2-fluorophenyl)-3-[(2R)-2-(4-fluorophenyl)morpholin-4-yl]propanamide
CID 30891589
2-[[2-(4-fluorophenoxy)acetyl]-propylamino]-N-(2-methylphenyl)acetamide
CID 38680702
N-[2-(2-methylanilino)-2-oxoethyl]-2-(4-phenyl-1,4-diazepan-1-yl)-N-propylacetamide
CID 112841143
3-[2-(4-fluorophenyl)morpholin-4-yl]-N-(2-methoxyphenyl)propanamide
CID 43065717
2-(2-methylmorpholin-4-yl)-N-(2-methylphenyl)acetamide
CID 51295683
N-(4-acetylphenyl)-2-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]acetamide
CID 36737265
2-amino-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide;hydrochloride
CID 119267479
2-[2-(4-fluorophenyl)morpholin-4-yl]-N-(2-methylpropyl)-N-propan-2-ylacetamide
CID 119041161

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-fluorophenyl)morpholin-4-yl]-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide?
The IUPAC name of 2-[2-(4-fluorophenyl)morpholin-4-yl]-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide (CID 112826133) is 2-[2-(4-fluorophenyl)morpholin-4-yl]-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide.
What is the SMILES notation for 2-[2-(4-fluorophenyl)morpholin-4-yl]-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide?
The canonical SMILES for 2-[2-(4-fluorophenyl)morpholin-4-yl]-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide is CCCN(CC(=O)Nc1ccccc1C)C(=O)CN1CCOC(c2ccc(F)cc2)C1.
What is the InChIKey of 2-[2-(4-fluorophenyl)morpholin-4-yl]-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide?
The InChIKey is IMVHGXQWQZWNMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30FN3O3/c1-3-12-28(16-23(29)26-21-7-5-4-6-18(21)2)24(30)17-27-13-14-31-22(15-27)19-8-10-20(25)11-9-19/h4-11,22H,3,12-17H2,1-2H3,(H,26,29).
What are the key properties of 2-[2-(4-fluorophenyl)morpholin-4-yl]-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide?
2-[2-(4-fluorophenyl)morpholin-4-yl]-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide has a molecular weight of 427.52 g/mol, XLogP of 3.38, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-fluorophenyl)morpholin-4-yl]-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylacetamide is sourced from PubChem (CID 112826133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).