N-[3-(diethylamino)-3-oxopropyl]-2-(4-fluorophenyl)morpholine-4-carboxamide

C18H26FN3O3 — CID 55934228

IUPACN-[3-(diethylamino)-3-oxopropyl]-2-(4-fluorophenyl)morpholine-4-carboxamide
SMILESCCN(CC)C(=O)CCNC(=O)N1CCOC(c2ccc(F)cc2)C1
InChIInChI=1S/C18H26FN3O3/c1-3-21(4-2)17(23)9-10-20-18(24)22-11-12-25-16(13-22)14-5-7-15(19)8-6-14/h5-8,16H,3-4,9-13H2,1-2H3,(H,20,24)
InChIKeySPQRGCKIZXOUES-UHFFFAOYSA-N
MW351.42 g/mol
LogP2.17
Rot. Bonds6

About N-[3-(diethylamino)-3-oxopropyl]-2-(4-fluorophenyl)morpholine-4-carboxamide

N-[3-(diethylamino)-3-oxopropyl]-2-(4-fluorophenyl)morpholine-4-carboxamide (PubChem CID 55934228) has the molecular formula C18H26FN3O3 and a molecular weight of 351.42 g/mol. Its IUPAC name is N-[3-(diethylamino)-3-oxopropyl]-2-(4-fluorophenyl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-[3-(diethylamino)-3-oxopropyl]-2-(4-fluorophenyl)morpholine-4-carboxamide
PubChem CID55934228
Molecular FormulaC18H26FN3O3
Molecular Weight351.42 g/mol
Exact Mass351.20
IUPAC NameN-[3-(diethylamino)-3-oxopropyl]-2-(4-fluorophenyl)morpholine-4-carboxamide
SMILESCCN(CC)C(=O)CCNC(=O)N1CCOC(c2ccc(F)cc2)C1
InChIInChI=1S/C18H26FN3O3/c1-3-21(4-2)17(23)9-10-20-18(24)22-11-12-25-16(13-22)14-5-7-15(19)8-6-14/h5-8,16H,3-4,9-13H2,1-2H3,(H,20,24)
InChIKeySPQRGCKIZXOUES-UHFFFAOYSA-N
XLogP2.17
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.42
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[3-(diethylamino)-3-oxopropyl]-2-(4-fluorophenyl)morpholine-4-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

2-(4-fluorophenyl)-N-[2-(2-methoxyphenoxy)ethyl]morpholine-4-carboxamide
CID 55770291
2-(4-chlorophenyl)-N-propylmorpholine-4-carboxamide
CID 47326521
2-chloro-1-[(2R)-2-(4-fluorophenyl)morpholin-4-yl]ethanone
CID 51889846
methyl (2S)-2-(4-fluorophenyl)morpholine-4-carboxylate
CID 67353366
(2S)-N-[2-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-2-(4-fluorophenyl)morpholine-4-carboxamide
CID 98786217
3-[2-(4-fluorophenyl)morpholin-4-yl]-3-oxopropanoic acid
CID 62231452
N-[3-[(2R)-2-(4-fluorophenyl)morpholin-4-yl]-3-oxopropyl]methanesulfonamide
CID 94023065
3-(cyclopropylamino)-1-[2-(4-fluorophenyl)morpholin-4-yl]propan-1-one
CID 60964272
2-(4-fluorophenyl)-N-[4,4,4-trifluoro-3-hydroxy-3-(1-methylimidazol-2-yl)butyl]morpholine-4-carboxamide
CID 55792890
(2R)-2-(4-fluorophenyl)-N-[(4-methyl-2-propyl-1,3-thiazol-5-yl)methyl]morpholine-4-carboxamide
CID 125443625
1-[2-(4-fluorophenyl)morpholin-4-yl]-3-methylsulfonylpropan-1-one
CID 131913070
1-[2-(4-ethylphenyl)morpholin-4-yl]-2-(4-fluorophenyl)ethanone
CID 110364011

Frequently Asked Questions

What is the IUPAC name of N-[3-(diethylamino)-3-oxopropyl]-2-(4-fluorophenyl)morpholine-4-carboxamide?
The IUPAC name of N-[3-(diethylamino)-3-oxopropyl]-2-(4-fluorophenyl)morpholine-4-carboxamide (CID 55934228) is N-[3-(diethylamino)-3-oxopropyl]-2-(4-fluorophenyl)morpholine-4-carboxamide.
What is the SMILES notation for N-[3-(diethylamino)-3-oxopropyl]-2-(4-fluorophenyl)morpholine-4-carboxamide?
The canonical SMILES for N-[3-(diethylamino)-3-oxopropyl]-2-(4-fluorophenyl)morpholine-4-carboxamide is CCN(CC)C(=O)CCNC(=O)N1CCOC(c2ccc(F)cc2)C1.
What is the InChIKey of N-[3-(diethylamino)-3-oxopropyl]-2-(4-fluorophenyl)morpholine-4-carboxamide?
The InChIKey is SPQRGCKIZXOUES-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26FN3O3/c1-3-21(4-2)17(23)9-10-20-18(24)22-11-12-25-16(13-22)14-5-7-15(19)8-6-14/h5-8,16H,3-4,9-13H2,1-2H3,(H,20,24).
What are the key properties of N-[3-(diethylamino)-3-oxopropyl]-2-(4-fluorophenyl)morpholine-4-carboxamide?
N-[3-(diethylamino)-3-oxopropyl]-2-(4-fluorophenyl)morpholine-4-carboxamide has a molecular weight of 351.42 g/mol, XLogP of 2.17, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(diethylamino)-3-oxopropyl]-2-(4-fluorophenyl)morpholine-4-carboxamide is sourced from PubChem (CID 55934228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).