4-[2-amino-1-(3-fluorophenyl)ethyl]morpholine-3-carboxamide

C13H18FN3O2 — CID 83102016

IUPAC4-[2-amino-1-(3-fluorophenyl)ethyl]morpholine-3-carboxamide
SMILESNCC(c1cccc(F)c1)N1CCOCC1C(N)=O
InChIInChI=1S/C13H18FN3O2/c14-10-3-1-2-9(6-10)11(7-15)17-4-5-19-8-12(17)13(16)18/h1-3,6,11-12H,4-5,7-8,15H2,(H2,16,18)
InChIKeySVAGZFKTVYKRNF-UHFFFAOYSA-N
MW267.30 g/mol
LogP0.01
Rot. Bonds4

About 4-[2-amino-1-(3-fluorophenyl)ethyl]morpholine-3-carboxamide

4-[2-amino-1-(3-fluorophenyl)ethyl]morpholine-3-carboxamide (PubChem CID 83102016) has the molecular formula C13H18FN3O2 and a molecular weight of 267.30 g/mol. Its IUPAC name is 4-[2-amino-1-(3-fluorophenyl)ethyl]morpholine-3-carboxamide.

Molecular Properties

Compound Name4-[2-amino-1-(3-fluorophenyl)ethyl]morpholine-3-carboxamide
PubChem CID83102016
Molecular FormulaC13H18FN3O2
Molecular Weight267.30 g/mol
Exact Mass267.14
IUPAC Name4-[2-amino-1-(3-fluorophenyl)ethyl]morpholine-3-carboxamide
SMILESNCC(c1cccc(F)c1)N1CCOCC1C(N)=O
InChIInChI=1S/C13H18FN3O2/c14-10-3-1-2-9(6-10)11(7-15)17-4-5-19-8-12(17)13(16)18/h1-3,6,11-12H,4-5,7-8,15H2,(H2,16,18)
InChIKeySVAGZFKTVYKRNF-UHFFFAOYSA-N
XLogP0.01
TPSA81.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.30
LogP ≤ 50.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-[2-amino-1-(3-fluorophenyl)ethyl]morpholine-3-carboxamide 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

4-(2-amino-1-thiophen-3-ylethyl)morpholine-3-carboxamide
CID 83102015
(3S)-4-[(2R)-2-(3-fluorophenyl)propanoyl]morpholine-3-carboxylic acid
CID 125154094
4-[(1R)-1-naphthalen-1-ylethyl]morpholine-3-carboxamide
CID 140628038
4-[[4-(aminomethyl)phenyl]methyl]morpholine-3-carboxamide
CID 83101444
1-[2-(3-fluorophenyl)-2-morpholin-4-ylethyl]-3-[(2-methylphenyl)methyl]urea
CID 60592552
4-amino-N-[2-(3-fluorophenyl)-2-morpholin-4-ylethyl]-3-methoxybutanamide
CID 120596042
2-(3-fluorophenyl)-2-(oxolan-3-yl)ethanamine
CID 83820646
2-(3-fluorophenyl)-2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)ethanamine
CID 102882695
2-[1-[2-amino-1-(3-fluorophenyl)ethyl]piperidin-2-yl]ethanol
CID 55020773
4-(2-amino-1-pyridin-4-ylethyl)-N-propylmorpholine-3-carboxamide
CID 83097966
1-amino-N-[2-(3-fluorophenyl)-2-morpholin-4-ylethyl]cyclopropane-1-carboxamide;dihydrochloride
CID 119865951
4-[2-(2,5-difluorophenyl)-2-oxoethyl]morpholine-3-carboxamide
CID 83096666

Frequently Asked Questions

What is the IUPAC name of 4-[2-amino-1-(3-fluorophenyl)ethyl]morpholine-3-carboxamide?
The IUPAC name of 4-[2-amino-1-(3-fluorophenyl)ethyl]morpholine-3-carboxamide (CID 83102016) is 4-[2-amino-1-(3-fluorophenyl)ethyl]morpholine-3-carboxamide.
What is the SMILES notation for 4-[2-amino-1-(3-fluorophenyl)ethyl]morpholine-3-carboxamide?
The canonical SMILES for 4-[2-amino-1-(3-fluorophenyl)ethyl]morpholine-3-carboxamide is NCC(c1cccc(F)c1)N1CCOCC1C(N)=O.
What is the InChIKey of 4-[2-amino-1-(3-fluorophenyl)ethyl]morpholine-3-carboxamide?
The InChIKey is SVAGZFKTVYKRNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18FN3O2/c14-10-3-1-2-9(6-10)11(7-15)17-4-5-19-8-12(17)13(16)18/h1-3,6,11-12H,4-5,7-8,15H2,(H2,16,18).
What are the key properties of 4-[2-amino-1-(3-fluorophenyl)ethyl]morpholine-3-carboxamide?
4-[2-amino-1-(3-fluorophenyl)ethyl]morpholine-3-carboxamide has a molecular weight of 267.30 g/mol, XLogP of 0.01, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-amino-1-(3-fluorophenyl)ethyl]morpholine-3-carboxamide is sourced from PubChem (CID 83102016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).