N-carbamoyl-2-[2-[1-(ethylamino)ethyl]-5-fluorophenoxy]propanamide

C14H20FN3O3 — CID 63066392

IUPACN-carbamoyl-2-[2-[1-(ethylamino)ethyl]-5-fluorophenoxy]propanamide
SMILESCCNC(C)c1ccc(F)cc1OC(C)C(=O)NC(N)=O
InChIInChI=1S/C14H20FN3O3/c1-4-17-8(2)11-6-5-10(15)7-12(11)21-9(3)13(19)18-14(16)20/h5-9,17H,4H2,1-3H3,(H3,16,18,19,20)
InChIKeyLBQVAARRYFKIPG-UHFFFAOYSA-N
MW297.33 g/mol
LogP1.46
Rot. Bonds6

About N-carbamoyl-2-[2-[1-(ethylamino)ethyl]-5-fluorophenoxy]propanamide

N-carbamoyl-2-[2-[1-(ethylamino)ethyl]-5-fluorophenoxy]propanamide (PubChem CID 63066392) has the molecular formula C14H20FN3O3 and a molecular weight of 297.33 g/mol. Its IUPAC name is N-carbamoyl-2-[2-[1-(ethylamino)ethyl]-5-fluorophenoxy]propanamide.

Molecular Properties

Compound NameN-carbamoyl-2-[2-[1-(ethylamino)ethyl]-5-fluorophenoxy]propanamide
PubChem CID63066392
Molecular FormulaC14H20FN3O3
Molecular Weight297.33 g/mol
Exact Mass297.15
IUPAC NameN-carbamoyl-2-[2-[1-(ethylamino)ethyl]-5-fluorophenoxy]propanamide
SMILESCCNC(C)c1ccc(F)cc1OC(C)C(=O)NC(N)=O
InChIInChI=1S/C14H20FN3O3/c1-4-17-8(2)11-6-5-10(15)7-12(11)21-9(3)13(19)18-14(16)20/h5-9,17H,4H2,1-3H3,(H3,16,18,19,20)
InChIKeyLBQVAARRYFKIPG-UHFFFAOYSA-N
XLogP1.46
TPSA93.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.33
LogP ≤ 51.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-carbamoyl-2-[2-[1-(ethylamino)ethyl]-5-fluorophenoxy]propanamide 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

2-[2-[(1S)-1-aminoethyl]-5-fluorophenoxy]-N-carbamoylpropanamide
CID 78935934
N-cyclopropyl-2-[2-[1-(ethylamino)ethyl]-5-fluorophenoxy]propanamide
CID 63066220
methyl 2-[2-[1-(ethylamino)ethyl]-5-fluorophenoxy]acetate
CID 63066050
2-[5-fluoro-2-[(1R)-1-hydroxyethyl]phenoxy]-N-(methylcarbamoyl)propanamide
CID 63366328
2-[5-fluoro-2-[(1S)-1-hydroxyethyl]phenoxy]propanamide
CID 63366141
(2S)-N-carbamoyl-2-(2-fluorophenoxy)propanamide
CID 7815239
2-[2-[(1S)-1-aminoethyl]-5-fluorophenoxy]-N-pentan-3-ylpropanamide
CID 63367985
2-[2-[(1R)-1-aminoethyl]-5-fluorophenoxy]-N-butan-2-ylpropanamide
CID 63368153
N-carbamoyl-2-[5-fluoro-2-[1-(methylamino)ethyl]phenoxy]acetamide
CID 63064124
2-[5-fluoro-2-[(1R)-1-hydroxyethyl]phenoxy]-N-pentan-3-ylpropanamide
CID 78934187
2-[2-[(1R)-1-aminoethyl]-5-fluorophenoxy]-N-(2-methylpropyl)propanamide
CID 63368087
N-ethyl-1-[4-fluoro-2-(2-methylpropoxy)phenyl]ethanamine
CID 63066393

Frequently Asked Questions

What is the IUPAC name of N-carbamoyl-2-[2-[1-(ethylamino)ethyl]-5-fluorophenoxy]propanamide?
The IUPAC name of N-carbamoyl-2-[2-[1-(ethylamino)ethyl]-5-fluorophenoxy]propanamide (CID 63066392) is N-carbamoyl-2-[2-[1-(ethylamino)ethyl]-5-fluorophenoxy]propanamide.
What is the SMILES notation for N-carbamoyl-2-[2-[1-(ethylamino)ethyl]-5-fluorophenoxy]propanamide?
The canonical SMILES for N-carbamoyl-2-[2-[1-(ethylamino)ethyl]-5-fluorophenoxy]propanamide is CCNC(C)c1ccc(F)cc1OC(C)C(=O)NC(N)=O.
What is the InChIKey of N-carbamoyl-2-[2-[1-(ethylamino)ethyl]-5-fluorophenoxy]propanamide?
The InChIKey is LBQVAARRYFKIPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FN3O3/c1-4-17-8(2)11-6-5-10(15)7-12(11)21-9(3)13(19)18-14(16)20/h5-9,17H,4H2,1-3H3,(H3,16,18,19,20).
What are the key properties of N-carbamoyl-2-[2-[1-(ethylamino)ethyl]-5-fluorophenoxy]propanamide?
N-carbamoyl-2-[2-[1-(ethylamino)ethyl]-5-fluorophenoxy]propanamide has a molecular weight of 297.33 g/mol, XLogP of 1.46, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-carbamoyl-2-[2-[1-(ethylamino)ethyl]-5-fluorophenoxy]propanamide is sourced from PubChem (CID 63066392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).