N-(2-amino-5-fluorophenyl)-2-(3-ethylmorpholin-4-yl)acetamide

C14H20FN3O2 — CID 43612167

IUPACN-(2-amino-5-fluorophenyl)-2-(3-ethylmorpholin-4-yl)acetamide
SMILESCCC1COCCN1CC(=O)Nc1cc(F)ccc1N
InChIInChI=1S/C14H20FN3O2/c1-2-11-9-20-6-5-18(11)8-14(19)17-13-7-10(15)3-4-12(13)16/h3-4,7,11H,2,5-6,8-9,16H2,1H3,(H,17,19)
InChIKeyBEBNMGJBUVNJKJ-UHFFFAOYSA-N
MW281.33 g/mol
LogP1.46
Rot. Bonds4

About N-(2-amino-5-fluorophenyl)-2-(3-ethylmorpholin-4-yl)acetamide

N-(2-amino-5-fluorophenyl)-2-(3-ethylmorpholin-4-yl)acetamide (PubChem CID 43612167) has the molecular formula C14H20FN3O2 and a molecular weight of 281.33 g/mol. Its IUPAC name is N-(2-amino-5-fluorophenyl)-2-(3-ethylmorpholin-4-yl)acetamide.

Molecular Properties

Compound NameN-(2-amino-5-fluorophenyl)-2-(3-ethylmorpholin-4-yl)acetamide
PubChem CID43612167
Molecular FormulaC14H20FN3O2
Molecular Weight281.33 g/mol
Exact Mass281.15
IUPAC NameN-(2-amino-5-fluorophenyl)-2-(3-ethylmorpholin-4-yl)acetamide
SMILESCCC1COCCN1CC(=O)Nc1cc(F)ccc1N
InChIInChI=1S/C14H20FN3O2/c1-2-11-9-20-6-5-18(11)8-14(19)17-13-7-10(15)3-4-12(13)16/h3-4,7,11H,2,5-6,8-9,16H2,1H3,(H,17,19)
InChIKeyBEBNMGJBUVNJKJ-UHFFFAOYSA-N
XLogP1.46
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.33
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(3-amino-4-fluorophenyl)-2-(3-ethylmorpholin-4-yl)acetamide
CID 43611694
N-(2-amino-5-fluorophenyl)-2-(2-ethyl-3-oxopiperazin-1-yl)acetamide
CID 63602687
N-(2-amino-5-fluorophenyl)-2-[2-(3-hydroxypropyl)pyrrolidin-1-yl]acetamide
CID 62467691
N-(3-carbamothioylphenyl)-2-(3-ethylmorpholin-4-yl)acetamide
CID 43613218
N-(4-cyanophenyl)-2-(3-ethylmorpholin-4-yl)acetamide
CID 43613167
N-(2-amino-5-chlorophenyl)-2-(2-ethylpyrrolidin-1-yl)acetamide
CID 54882932
N-(2-amino-5-fluorophenyl)-2-(3,5-diethylpyrazol-1-yl)acetamide
CID 82695813
2-[(3-ethylmorpholin-4-yl)methyl]-4-fluorobenzoic acid
CID 114014611
N-(2-amino-5-fluorophenyl)-2-(4-cyclopropylpiperazin-1-yl)acetamide
CID 61440078
N-(2-amino-5-fluorophenyl)-2-[(2S,6R)-2,6-dimethylpiperidin-1-yl]acetamide
CID 104967022
2-amino-N-(2-amino-5-fluorophenyl)acetamide
CID 110477650
N-(2-amino-5-fluorophenyl)-2-(oxan-4-ylsulfanyl)acetamide
CID 62995341

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-5-fluorophenyl)-2-(3-ethylmorpholin-4-yl)acetamide?
The IUPAC name of N-(2-amino-5-fluorophenyl)-2-(3-ethylmorpholin-4-yl)acetamide (CID 43612167) is N-(2-amino-5-fluorophenyl)-2-(3-ethylmorpholin-4-yl)acetamide.
What is the SMILES notation for N-(2-amino-5-fluorophenyl)-2-(3-ethylmorpholin-4-yl)acetamide?
The canonical SMILES for N-(2-amino-5-fluorophenyl)-2-(3-ethylmorpholin-4-yl)acetamide is CCC1COCCN1CC(=O)Nc1cc(F)ccc1N.
What is the InChIKey of N-(2-amino-5-fluorophenyl)-2-(3-ethylmorpholin-4-yl)acetamide?
The InChIKey is BEBNMGJBUVNJKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FN3O2/c1-2-11-9-20-6-5-18(11)8-14(19)17-13-7-10(15)3-4-12(13)16/h3-4,7,11H,2,5-6,8-9,16H2,1H3,(H,17,19).
What are the key properties of N-(2-amino-5-fluorophenyl)-2-(3-ethylmorpholin-4-yl)acetamide?
N-(2-amino-5-fluorophenyl)-2-(3-ethylmorpholin-4-yl)acetamide has a molecular weight of 281.33 g/mol, XLogP of 1.46, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-5-fluorophenyl)-2-(3-ethylmorpholin-4-yl)acetamide is sourced from PubChem (CID 43612167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).