2-[(4-fluorophenyl)methylamino]-N-(2-morpholin-4-ylethyl)acetamide

C15H22FN3O2 — CID 108994887

IUPAC2-[(4-fluorophenyl)methylamino]-N-(2-morpholin-4-ylethyl)acetamide
SMILESO=C(CNCc1ccc(F)cc1)NCCN1CCOCC1
InChIInChI=1S/C15H22FN3O2/c16-14-3-1-13(2-4-14)11-17-12-15(20)18-5-6-19-7-9-21-10-8-19/h1-4,17H,5-12H2,(H,18,20)
InChIKeyHSMYBWZMXBMXDE-UHFFFAOYSA-N
MW295.36 g/mol
LogP0.36
Rot. Bonds7

About 2-[(4-fluorophenyl)methylamino]-N-(2-morpholin-4-ylethyl)acetamide

2-[(4-fluorophenyl)methylamino]-N-(2-morpholin-4-ylethyl)acetamide (PubChem CID 108994887) has the molecular formula C15H22FN3O2 and a molecular weight of 295.36 g/mol. Its IUPAC name is 2-[(4-fluorophenyl)methylamino]-N-(2-morpholin-4-ylethyl)acetamide.

Molecular Properties

Compound Name2-[(4-fluorophenyl)methylamino]-N-(2-morpholin-4-ylethyl)acetamide
PubChem CID108994887
Molecular FormulaC15H22FN3O2
Molecular Weight295.36 g/mol
Exact Mass295.17
IUPAC Name2-[(4-fluorophenyl)methylamino]-N-(2-morpholin-4-ylethyl)acetamide
SMILESO=C(CNCc1ccc(F)cc1)NCCN1CCOCC1
InChIInChI=1S/C15H22FN3O2/c16-14-3-1-13(2-4-14)11-17-12-15(20)18-5-6-19-7-9-21-10-8-19/h1-4,17H,5-12H2,(H,18,20)
InChIKeyHSMYBWZMXBMXDE-UHFFFAOYSA-N
XLogP0.36
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.36
LogP ≤ 50.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(4-fluorophenyl)-2-methyl-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]propanamide
CID 110305497
3-(4-fluoroanilino)-N-(2-morpholin-4-ylethyl)propanamide
CID 109016608
1-N-[2-(4-fluorophenyl)ethyl]-4-N-(2-morpholin-4-ylethyl)benzene-1,4-dicarboxamide
CID 109045881
N-[(4-fluorophenyl)methyl]-2-[(4-fluorophenyl)methylamino]acetamide
CID 108997698
5-bromo-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]furan-2-carboxamide
CID 51163910
2-(4-hydroxyphenyl)-N-(2-morpholin-4-ylethyl)acetamide
CID 78823248
6-[(4-fluorophenyl)methylamino]-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide
CID 109115658
4-[(2-morpholin-4-ylethylamino)methyl]benzoic acid;dihydrochloride
CID 17159786
2-amino-5-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)pentanamide
CID 126595681
2-(4-fluorophenyl)-N-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethyl]acetamide
CID 42266590
4-[(2-morpholin-4-ylethylamino)methyl]benzamide
CID 28583134
1-[(4-methylphenyl)methyl]-3-(2-morpholin-4-ylethyl)urea
CID 33427522

Frequently Asked Questions

What is the IUPAC name of 2-[(4-fluorophenyl)methylamino]-N-(2-morpholin-4-ylethyl)acetamide?
The IUPAC name of 2-[(4-fluorophenyl)methylamino]-N-(2-morpholin-4-ylethyl)acetamide (CID 108994887) is 2-[(4-fluorophenyl)methylamino]-N-(2-morpholin-4-ylethyl)acetamide.
What is the SMILES notation for 2-[(4-fluorophenyl)methylamino]-N-(2-morpholin-4-ylethyl)acetamide?
The canonical SMILES for 2-[(4-fluorophenyl)methylamino]-N-(2-morpholin-4-ylethyl)acetamide is O=C(CNCc1ccc(F)cc1)NCCN1CCOCC1.
What is the InChIKey of 2-[(4-fluorophenyl)methylamino]-N-(2-morpholin-4-ylethyl)acetamide?
The InChIKey is HSMYBWZMXBMXDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FN3O2/c16-14-3-1-13(2-4-14)11-17-12-15(20)18-5-6-19-7-9-21-10-8-19/h1-4,17H,5-12H2,(H,18,20).
What are the key properties of 2-[(4-fluorophenyl)methylamino]-N-(2-morpholin-4-ylethyl)acetamide?
2-[(4-fluorophenyl)methylamino]-N-(2-morpholin-4-ylethyl)acetamide has a molecular weight of 295.36 g/mol, XLogP of 0.36, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-fluorophenyl)methylamino]-N-(2-morpholin-4-ylethyl)acetamide is sourced from PubChem (CID 108994887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).