N-(5-fluoro-2-morpholin-4-ylphenyl)oxane-4-carboxamide

C16H21FN2O3 — CID 113092739

IUPACN-(5-fluoro-2-morpholin-4-ylphenyl)oxane-4-carboxamide
SMILESO=C(Nc1cc(F)ccc1N1CCOCC1)C1CCOCC1
InChIInChI=1S/C16H21FN2O3/c17-13-1-2-15(19-5-9-22-10-6-19)14(11-13)18-16(20)12-3-7-21-8-4-12/h1-2,11-12H,3-10H2,(H,18,20)
InChIKeyAPTQJUDDAMZOEZ-UHFFFAOYSA-N
MW308.35 g/mol
LogP2.03
Rot. Bonds3

About N-(5-fluoro-2-morpholin-4-ylphenyl)oxane-4-carboxamide

N-(5-fluoro-2-morpholin-4-ylphenyl)oxane-4-carboxamide (PubChem CID 113092739) has the molecular formula C16H21FN2O3 and a molecular weight of 308.35 g/mol. Its IUPAC name is N-(5-fluoro-2-morpholin-4-ylphenyl)oxane-4-carboxamide.

Molecular Properties

Compound NameN-(5-fluoro-2-morpholin-4-ylphenyl)oxane-4-carboxamide
PubChem CID113092739
Molecular FormulaC16H21FN2O3
Molecular Weight308.35 g/mol
Exact Mass308.15
IUPAC NameN-(5-fluoro-2-morpholin-4-ylphenyl)oxane-4-carboxamide
SMILESO=C(Nc1cc(F)ccc1N1CCOCC1)C1CCOCC1
InChIInChI=1S/C16H21FN2O3/c17-13-1-2-15(19-5-9-22-10-6-19)14(11-13)18-16(20)12-3-7-21-8-4-12/h1-2,11-12H,3-10H2,(H,18,20)
InChIKeyAPTQJUDDAMZOEZ-UHFFFAOYSA-N
XLogP2.03
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.35
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(5-fluoro-2-morpholin-4-ylphenyl)oxane-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

N-(5-fluoro-2-piperidin-1-ylphenyl)oxane-4-carboxamide
CID 113092620
N-(5-fluoro-2-pyrrolidin-1-ylphenyl)cyclobutanecarboxamide
CID 113092391
N-(5-fluoro-2-morpholin-4-ylphenyl)-2,2-dimethylpropanamide
CID 113092676
4-fluoro-N-(5-fluoro-2-morpholin-4-ylphenyl)benzamide
CID 113092686
N-[5-chloro-2-(4-methylpiperazin-1-yl)phenyl]oxane-4-carboxamide
CID 30971775
4-bromo-N-(5-fluoro-2-morpholin-4-ylphenyl)benzamide
CID 113092689
N-(2-morpholin-4-ylphenyl)piperidine-4-carboxamide
CID 43708109
N-(5-fluoro-2-morpholin-4-ylphenyl)-4-(trifluoromethyl)benzamide
CID 113092724
N-(5-fluoro-2-morpholin-4-ylphenyl)furan-2-carboxamide
CID 113092678
N-(2-morpholin-4-yl-5-morpholin-4-ylsulfonylphenyl)cyclopentanecarboxamide
CID 3938418
N-(5-fluoro-2-morpholin-4-ylphenyl)-2,6-dimethoxybenzamide
CID 113092695
N-(5-fluoro-2-morpholin-4-ylphenyl)-2-methylbenzamide
CID 113092681

Frequently Asked Questions

What is the IUPAC name of N-(5-fluoro-2-morpholin-4-ylphenyl)oxane-4-carboxamide?
The IUPAC name of N-(5-fluoro-2-morpholin-4-ylphenyl)oxane-4-carboxamide (CID 113092739) is N-(5-fluoro-2-morpholin-4-ylphenyl)oxane-4-carboxamide.
What is the SMILES notation for N-(5-fluoro-2-morpholin-4-ylphenyl)oxane-4-carboxamide?
The canonical SMILES for N-(5-fluoro-2-morpholin-4-ylphenyl)oxane-4-carboxamide is O=C(Nc1cc(F)ccc1N1CCOCC1)C1CCOCC1.
What is the InChIKey of N-(5-fluoro-2-morpholin-4-ylphenyl)oxane-4-carboxamide?
The InChIKey is APTQJUDDAMZOEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21FN2O3/c17-13-1-2-15(19-5-9-22-10-6-19)14(11-13)18-16(20)12-3-7-21-8-4-12/h1-2,11-12H,3-10H2,(H,18,20).
What are the key properties of N-(5-fluoro-2-morpholin-4-ylphenyl)oxane-4-carboxamide?
N-(5-fluoro-2-morpholin-4-ylphenyl)oxane-4-carboxamide has a molecular weight of 308.35 g/mol, XLogP of 2.03, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-fluoro-2-morpholin-4-ylphenyl)oxane-4-carboxamide is sourced from PubChem (CID 113092739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).