2-(4-fluorophenyl)-N-(2-methoxy-5-morpholin-4-ylphenyl)butanamide

C21H25FN2O3 — CID 110355315

IUPAC2-(4-fluorophenyl)-N-(2-methoxy-5-morpholin-4-ylphenyl)butanamide
SMILESCCC(C(=O)Nc1cc(N2CCOCC2)ccc1OC)c1ccc(F)cc1
InChIInChI=1S/C21H25FN2O3/c1-3-18(15-4-6-16(22)7-5-15)21(25)23-19-14-17(8-9-20(19)26-2)24-10-12-27-13-11-24/h4-9,14,18H,3,10-13H2,1-2H3,(H,23,25)
InChIKeyFRHFUYRZKPPSRH-UHFFFAOYSA-N
MW372.44 g/mol
LogP3.80
Rot. Bonds6

About 2-(4-fluorophenyl)-N-(2-methoxy-5-morpholin-4-ylphenyl)butanamide

2-(4-fluorophenyl)-N-(2-methoxy-5-morpholin-4-ylphenyl)butanamide (PubChem CID 110355315) has the molecular formula C21H25FN2O3 and a molecular weight of 372.44 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-N-(2-methoxy-5-morpholin-4-ylphenyl)butanamide.

Molecular Properties

Compound Name2-(4-fluorophenyl)-N-(2-methoxy-5-morpholin-4-ylphenyl)butanamide
PubChem CID110355315
Molecular FormulaC21H25FN2O3
Molecular Weight372.44 g/mol
Exact Mass372.18
IUPAC Name2-(4-fluorophenyl)-N-(2-methoxy-5-morpholin-4-ylphenyl)butanamide
SMILESCCC(C(=O)Nc1cc(N2CCOCC2)ccc1OC)c1ccc(F)cc1
InChIInChI=1S/C21H25FN2O3/c1-3-18(15-4-6-16(22)7-5-15)21(25)23-19-14-17(8-9-20(19)26-2)24-10-12-27-13-11-24/h4-9,14,18H,3,10-13H2,1-2H3,(H,23,25)
InChIKeyFRHFUYRZKPPSRH-UHFFFAOYSA-N
XLogP3.80
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.44
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

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Related Compounds

2-ethyl-N-(2-methoxy-5-morpholin-4-ylphenyl)butanamide
CID 110359745
N-(2-methoxy-5-morpholin-4-ylphenyl)pentanamide
CID 110359739
2-(2-methoxy-5-morpholin-4-ylanilino)-2-sulfanylideneacetamide
CID 11254914
N-(2-methoxy-5-morpholin-4-ylphenyl)pyridine-4-carboxamide
CID 84508322
2-(3,4-dimethoxyphenyl)-2-[(4-fluorophenyl)methyl-(2-phenylacetyl)amino]-N-(4-morpholin-4-ylphenyl)acetamide
CID 43821479
N'-(2,5-dimethoxyphenyl)-N-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]oxamide
CID 18589257
N-(2-fluoro-5-morpholin-4-ylphenyl)-2-methylpropanamide
CID 110362575
2-bromo-N-(2-methoxy-5-morpholin-4-ylphenyl)benzamide
CID 110359755
1-[5-(4-formylpiperazin-1-yl)-2-methoxyphenyl]-3-(oxan-4-yl)urea
CID 110613966
N-[1-(4-methoxy-3-methylphenyl)propyl]-4-morpholin-4-ylbenzamide
CID 133161272
N-(2,5-dimethoxyphenyl)-2-(4-fluorophenyl)-3-(furan-2-yl)propanamide
CID 110296223
(2S)-2-[4-(4-fluorophenyl)piperazin-1-yl]-N-(2-methoxy-5-nitrophenyl)propanamide
CID 2368536

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-N-(2-methoxy-5-morpholin-4-ylphenyl)butanamide?
The IUPAC name of 2-(4-fluorophenyl)-N-(2-methoxy-5-morpholin-4-ylphenyl)butanamide (CID 110355315) is 2-(4-fluorophenyl)-N-(2-methoxy-5-morpholin-4-ylphenyl)butanamide.
What is the SMILES notation for 2-(4-fluorophenyl)-N-(2-methoxy-5-morpholin-4-ylphenyl)butanamide?
The canonical SMILES for 2-(4-fluorophenyl)-N-(2-methoxy-5-morpholin-4-ylphenyl)butanamide is CCC(C(=O)Nc1cc(N2CCOCC2)ccc1OC)c1ccc(F)cc1.
What is the InChIKey of 2-(4-fluorophenyl)-N-(2-methoxy-5-morpholin-4-ylphenyl)butanamide?
The InChIKey is FRHFUYRZKPPSRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25FN2O3/c1-3-18(15-4-6-16(22)7-5-15)21(25)23-19-14-17(8-9-20(19)26-2)24-10-12-27-13-11-24/h4-9,14,18H,3,10-13H2,1-2H3,(H,23,25).
What are the key properties of 2-(4-fluorophenyl)-N-(2-methoxy-5-morpholin-4-ylphenyl)butanamide?
2-(4-fluorophenyl)-N-(2-methoxy-5-morpholin-4-ylphenyl)butanamide has a molecular weight of 372.44 g/mol, XLogP of 3.80, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-N-(2-methoxy-5-morpholin-4-ylphenyl)butanamide is sourced from PubChem (CID 110355315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).