4-fluoro-N-(5-methoxy-2-morpholin-4-ylphenyl)benzamide

C18H19FN2O3 — CID 6473304

IUPAC4-fluoro-N-(5-methoxy-2-morpholin-4-ylphenyl)benzamide
SMILESCOc1ccc(N2CCOCC2)c(NC(=O)c2ccc(F)cc2)c1
InChIInChI=1S/C18H19FN2O3/c1-23-15-6-7-17(21-8-10-24-11-9-21)16(12-15)20-18(22)13-2-4-14(19)5-3-13/h2-7,12H,8-11H2,1H3,(H,20,22)
InChIKeyPMEWYNAWANUXQU-UHFFFAOYSA-N
MW330.36 g/mol
LogP2.92
Rot. Bonds4

About 4-fluoro-N-(5-methoxy-2-morpholin-4-ylphenyl)benzamide

4-fluoro-N-(5-methoxy-2-morpholin-4-ylphenyl)benzamide (PubChem CID 6473304) has the molecular formula C18H19FN2O3 and a molecular weight of 330.36 g/mol. Its IUPAC name is 4-fluoro-N-(5-methoxy-2-morpholin-4-ylphenyl)benzamide.

Molecular Properties

Compound Name4-fluoro-N-(5-methoxy-2-morpholin-4-ylphenyl)benzamide
PubChem CID6473304
Molecular FormulaC18H19FN2O3
Molecular Weight330.36 g/mol
Exact Mass330.14
IUPAC Name4-fluoro-N-(5-methoxy-2-morpholin-4-ylphenyl)benzamide
SMILESCOc1ccc(N2CCOCC2)c(NC(=O)c2ccc(F)cc2)c1
InChIInChI=1S/C18H19FN2O3/c1-23-15-6-7-17(21-8-10-24-11-9-21)16(12-15)20-18(22)13-2-4-14(19)5-3-13/h2-7,12H,8-11H2,1H3,(H,20,22)
InChIKeyPMEWYNAWANUXQU-UHFFFAOYSA-N
XLogP2.92
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.36
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

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Related Compounds

4-fluoro-N-(5-fluoro-2-morpholin-4-ylphenyl)benzamide
CID 113092686
N-(5-fluoro-2-morpholin-4-ylphenyl)-3-methoxybenzamide
CID 113092691
N-(5-methoxy-2-morpholin-4-ylphenyl)-3,4-dimethylbenzamide
CID 17027218
3-[(4-fluorobenzoyl)amino]-4-morpholin-4-ylbenzoic acid
CID 53052897
N-(5-fluoro-2-pyrrolidin-1-ylphenyl)-4-methoxybenzamide
CID 113092344
4-methoxy-N-(5-morpholin-4-yl-2-pyrrolidin-1-ylphenyl)benzamide
CID 110400402
N-(5-methoxy-2-morpholin-4-ylphenyl)pyridine-3-carboxamide
CID 6473397
4-fluoro-N-(2-morpholin-4-yl-5-pyrrolidin-1-ylphenyl)benzamide
CID 110400459
4-bromo-N-(5-fluoro-2-morpholin-4-ylphenyl)benzamide
CID 113092689
N-(5-fluoro-2-morpholin-4-ylphenyl)-4-(trifluoromethyl)benzamide
CID 113092724
N-(5-fluoro-2-morpholin-4-ylphenyl)-2,6-dimethoxybenzamide
CID 113092695
4-methoxy-N-[2-morpholin-4-yl-5-(tetrazol-1-yl)phenyl]benzamide
CID 50776826

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-(5-methoxy-2-morpholin-4-ylphenyl)benzamide?
The IUPAC name of 4-fluoro-N-(5-methoxy-2-morpholin-4-ylphenyl)benzamide (CID 6473304) is 4-fluoro-N-(5-methoxy-2-morpholin-4-ylphenyl)benzamide.
What is the SMILES notation for 4-fluoro-N-(5-methoxy-2-morpholin-4-ylphenyl)benzamide?
The canonical SMILES for 4-fluoro-N-(5-methoxy-2-morpholin-4-ylphenyl)benzamide is COc1ccc(N2CCOCC2)c(NC(=O)c2ccc(F)cc2)c1.
What is the InChIKey of 4-fluoro-N-(5-methoxy-2-morpholin-4-ylphenyl)benzamide?
The InChIKey is PMEWYNAWANUXQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN2O3/c1-23-15-6-7-17(21-8-10-24-11-9-21)16(12-15)20-18(22)13-2-4-14(19)5-3-13/h2-7,12H,8-11H2,1H3,(H,20,22).
What are the key properties of 4-fluoro-N-(5-methoxy-2-morpholin-4-ylphenyl)benzamide?
4-fluoro-N-(5-methoxy-2-morpholin-4-ylphenyl)benzamide has a molecular weight of 330.36 g/mol, XLogP of 2.92, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-(5-methoxy-2-morpholin-4-ylphenyl)benzamide is sourced from PubChem (CID 6473304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).