3-(4-fluorophenyl)-N-[4-(2-methylmorpholine-4-carbonyl)phenyl]butanamide

C22H25FN2O3 — CID 110620048

IUPAC3-(4-fluorophenyl)-N-[4-(2-methylmorpholine-4-carbonyl)phenyl]butanamide
SMILESCC1CN(C(=O)c2ccc(NC(=O)CC(C)c3ccc(F)cc3)cc2)CCO1
InChIInChI=1S/C22H25FN2O3/c1-15(17-3-7-19(23)8-4-17)13-21(26)24-20-9-5-18(6-10-20)22(27)25-11-12-28-16(2)14-25/h3-10,15-16H,11-14H2,1-2H3,(H,24,26)
InChIKeyRABLBHHGBYUWKN-UHFFFAOYSA-N
MW384.45 g/mol
LogP3.82
Rot. Bonds5

About 3-(4-fluorophenyl)-N-[4-(2-methylmorpholine-4-carbonyl)phenyl]butanamide

3-(4-fluorophenyl)-N-[4-(2-methylmorpholine-4-carbonyl)phenyl]butanamide (PubChem CID 110620048) has the molecular formula C22H25FN2O3 and a molecular weight of 384.45 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-N-[4-(2-methylmorpholine-4-carbonyl)phenyl]butanamide.

Molecular Properties

Compound Name3-(4-fluorophenyl)-N-[4-(2-methylmorpholine-4-carbonyl)phenyl]butanamide
PubChem CID110620048
Molecular FormulaC22H25FN2O3
Molecular Weight384.45 g/mol
Exact Mass384.18
IUPAC Name3-(4-fluorophenyl)-N-[4-(2-methylmorpholine-4-carbonyl)phenyl]butanamide
SMILESCC1CN(C(=O)c2ccc(NC(=O)CC(C)c3ccc(F)cc3)cc2)CCO1
InChIInChI=1S/C22H25FN2O3/c1-15(17-3-7-19(23)8-4-17)13-21(26)24-20-9-5-18(6-10-20)22(27)25-11-12-28-16(2)14-25/h3-10,15-16H,11-14H2,1-2H3,(H,24,26)
InChIKeyRABLBHHGBYUWKN-UHFFFAOYSA-N
XLogP3.82
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.45
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(4-fluorophenyl)-N-[4-(2-methylmorpholine-4-carbonyl)phenyl]butanamide 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

3-methyl-N-[4-(2-methylmorpholine-4-carbonyl)phenyl]butanamide
CID 110352683
3-cyclopropyl-N-[4-(2-methylmorpholine-4-carbonyl)phenyl]-3-phenylpropanamide
CID 110426734
[4-(methylamino)phenyl]-(2-methylmorpholin-4-yl)methanone
CID 62173081
4-fluoro-N-[3-(2-methylmorpholine-4-carbonyl)phenyl]benzamide
CID 46430432
N-[4-(2-methylmorpholine-4-carbonyl)phenyl]-3-(2-methylphenyl)propanamide
CID 110671816
N-[4-(2-methylmorpholine-4-carbonyl)phenyl]-3-phenoxypropanamide
CID 110352712
2-(4-fluorophenyl)-3-methyl-1-(2-methylmorpholin-4-yl)butan-1-one
CID 110313844
(3S)-N-(4-fluorophenyl)-3-phenylbutanamide
CID 1122411
2-cyclopropyl-2-(4-fluorophenyl)-N-[3-(2-methylmorpholine-4-carbonyl)phenyl]acetamide
CID 110614506
(E)-N-(4-fluorophenyl)-4-(2-methylmorpholin-4-yl)-4-oxobut-2-enamide
CID 51105577
N-[4-(2-methylmorpholine-4-carbonyl)phenyl]methanesulfonamide
CID 46510193
N-[4-(3-methylmorpholine-4-carbonyl)phenyl]-3-phenylbutanamide
CID 110614350

Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)-N-[4-(2-methylmorpholine-4-carbonyl)phenyl]butanamide?
The IUPAC name of 3-(4-fluorophenyl)-N-[4-(2-methylmorpholine-4-carbonyl)phenyl]butanamide (CID 110620048) is 3-(4-fluorophenyl)-N-[4-(2-methylmorpholine-4-carbonyl)phenyl]butanamide.
What is the SMILES notation for 3-(4-fluorophenyl)-N-[4-(2-methylmorpholine-4-carbonyl)phenyl]butanamide?
The canonical SMILES for 3-(4-fluorophenyl)-N-[4-(2-methylmorpholine-4-carbonyl)phenyl]butanamide is CC1CN(C(=O)c2ccc(NC(=O)CC(C)c3ccc(F)cc3)cc2)CCO1.
What is the InChIKey of 3-(4-fluorophenyl)-N-[4-(2-methylmorpholine-4-carbonyl)phenyl]butanamide?
The InChIKey is RABLBHHGBYUWKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25FN2O3/c1-15(17-3-7-19(23)8-4-17)13-21(26)24-20-9-5-18(6-10-20)22(27)25-11-12-28-16(2)14-25/h3-10,15-16H,11-14H2,1-2H3,(H,24,26).
What are the key properties of 3-(4-fluorophenyl)-N-[4-(2-methylmorpholine-4-carbonyl)phenyl]butanamide?
3-(4-fluorophenyl)-N-[4-(2-methylmorpholine-4-carbonyl)phenyl]butanamide has a molecular weight of 384.45 g/mol, XLogP of 3.82, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-N-[4-(2-methylmorpholine-4-carbonyl)phenyl]butanamide is sourced from PubChem (CID 110620048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).