2-fluoro-N-(4-morpholin-4-ylphenyl)benzamide

C17H17FN2O2 — CID 781635

IUPAC2-fluoro-N-(4-morpholin-4-ylphenyl)benzamide
SMILESO=C(Nc1ccc(N2CCOCC2)cc1)c1ccccc1F
InChIInChI=1S/C17H17FN2O2/c18-16-4-2-1-3-15(16)17(21)19-13-5-7-14(8-6-13)20-9-11-22-12-10-20/h1-8H,9-12H2,(H,19,21)
InChIKeyDHJBIFQKIDWHJV-UHFFFAOYSA-N
MW300.33 g/mol
LogP2.91
Rot. Bonds3

About 2-fluoro-N-(4-morpholin-4-ylphenyl)benzamide

2-fluoro-N-(4-morpholin-4-ylphenyl)benzamide (PubChem CID 781635) has the molecular formula C17H17FN2O2 and a molecular weight of 300.33 g/mol. Its IUPAC name is 2-fluoro-N-(4-morpholin-4-ylphenyl)benzamide.

Molecular Properties

Compound Name2-fluoro-N-(4-morpholin-4-ylphenyl)benzamide
PubChem CID781635
Molecular FormulaC17H17FN2O2
Molecular Weight300.33 g/mol
Exact Mass300.13
IUPAC Name2-fluoro-N-(4-morpholin-4-ylphenyl)benzamide
SMILESO=C(Nc1ccc(N2CCOCC2)cc1)c1ccccc1F
InChIInChI=1S/C17H17FN2O2/c18-16-4-2-1-3-15(16)17(21)19-13-5-7-14(8-6-13)20-9-11-22-12-10-20/h1-8H,9-12H2,(H,19,21)
InChIKeyDHJBIFQKIDWHJV-UHFFFAOYSA-N
XLogP2.91
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.33
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

2-fluoro-N-(3-morpholin-4-ylphenyl)benzamide
CID 110362329
2-fluoro-N-[4-[4-(2-fluorobenzoyl)piperazin-1-yl]phenyl]benzamide
CID 17273892
2-bromo-N-(4-morpholin-4-ylphenyl)benzamide
CID 1181771
2-fluoro-N-[4-(3-oxomorpholin-4-yl)phenyl]benzamide
CID 110363540
2-fluoro-N-[4-[[3-morpholin-4-yl-5-(trifluoromethyl)phenyl]carbamothioylamino]phenyl]benzamide
CID 15955556
2-fluoro-N-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]benzamide
CID 1087170
2-(methanesulfonamido)-N-(4-morpholin-4-ylphenyl)benzamide
CID 100519885
2-fluoro-N-[(4-morpholin-4-ylphenyl)methylideneamino]benzamide
CID 2330481
2-fluoro-N-(5-morpholin-4-yl-2-pyrrolidin-1-ylphenyl)benzamide
CID 110400396
N-(4-morpholin-4-ylphenyl)-2-phenoxybenzamide
CID 8961117
2-[2-[[4-[(4-morpholin-4-ylphenyl)carbamoyl]phenyl]carbamoyl]phenyl]benzoic acid
CID 24984100
2-amino-N-(4-morpholin-4-ylphenyl)pyridine-3-carboxamide
CID 82545859

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-(4-morpholin-4-ylphenyl)benzamide?
The IUPAC name of 2-fluoro-N-(4-morpholin-4-ylphenyl)benzamide (CID 781635) is 2-fluoro-N-(4-morpholin-4-ylphenyl)benzamide.
What is the SMILES notation for 2-fluoro-N-(4-morpholin-4-ylphenyl)benzamide?
The canonical SMILES for 2-fluoro-N-(4-morpholin-4-ylphenyl)benzamide is O=C(Nc1ccc(N2CCOCC2)cc1)c1ccccc1F.
What is the InChIKey of 2-fluoro-N-(4-morpholin-4-ylphenyl)benzamide?
The InChIKey is DHJBIFQKIDWHJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FN2O2/c18-16-4-2-1-3-15(16)17(21)19-13-5-7-14(8-6-13)20-9-11-22-12-10-20/h1-8H,9-12H2,(H,19,21).
What are the key properties of 2-fluoro-N-(4-morpholin-4-ylphenyl)benzamide?
2-fluoro-N-(4-morpholin-4-ylphenyl)benzamide has a molecular weight of 300.33 g/mol, XLogP of 2.91, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-(4-morpholin-4-ylphenyl)benzamide is sourced from PubChem (CID 781635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).