N-(2,4-difluorophenyl)-4-morpholin-4-ylbenzamide

C17H16F2N2O2 — CID 53282259

IUPACN-(2,4-difluorophenyl)-4-morpholin-4-ylbenzamide
SMILESO=C(Nc1ccc(F)cc1F)c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C17H16F2N2O2/c18-13-3-6-16(15(19)11-13)20-17(22)12-1-4-14(5-2-12)21-7-9-23-10-8-21/h1-6,11H,7-10H2,(H,20,22)
InChIKeyORYIYQGWECVPOH-UHFFFAOYSA-N
MW318.32 g/mol
LogP3.05
Rot. Bonds3

About N-(2,4-difluorophenyl)-4-morpholin-4-ylbenzamide

N-(2,4-difluorophenyl)-4-morpholin-4-ylbenzamide (PubChem CID 53282259) has the molecular formula C17H16F2N2O2 and a molecular weight of 318.32 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-4-morpholin-4-ylbenzamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-4-morpholin-4-ylbenzamide
PubChem CID53282259
Molecular FormulaC17H16F2N2O2
Molecular Weight318.32 g/mol
Exact Mass318.12
IUPAC NameN-(2,4-difluorophenyl)-4-morpholin-4-ylbenzamide
SMILESO=C(Nc1ccc(F)cc1F)c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C17H16F2N2O2/c18-13-3-6-16(15(19)11-13)20-17(22)12-1-4-14(5-2-12)21-7-9-23-10-8-21/h1-6,11H,7-10H2,(H,20,22)
InChIKeyORYIYQGWECVPOH-UHFFFAOYSA-N
XLogP3.05
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.32
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-fluoro-N-(5-fluoro-2-morpholin-4-ylphenyl)benzamide
CID 113092686
4-fluoro-N-(2-morpholin-4-yl-5-pyrrolidin-1-ylphenyl)benzamide
CID 110400459
N-(2,4-difluorophenyl)-4-(4-propan-2-ylpiperazin-1-yl)benzamide
CID 48732675
1-N,4-N-bis(2,4-difluorophenyl)benzene-1,4-dicarboxamide
CID 3596826
4-bromo-N-(5-fluoro-2-morpholin-4-ylphenyl)benzamide
CID 113092689
4-N-(2,4-difluorophenyl)-1-N-(2-morpholin-4-ylethyl)benzene-1,4-dicarboxamide
CID 109045931
4-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-(2,4-difluorophenyl)benzamide
CID 110426763
3-[(4-fluorobenzoyl)amino]-4-morpholin-4-ylbenzoic acid
CID 53052897
N-(5-fluoro-2-morpholin-4-ylphenyl)-4-(trifluoromethyl)benzamide
CID 113092724
N-(2,4-dimorpholin-4-ylphenyl)-3-fluorobenzamide
CID 4824008
3-(2,4-difluorophenyl)-1-methyl-1-[(4-morpholin-4-ylphenyl)methyl]urea
CID 46649991
3-fluoro-N-(5-morpholin-4-yl-2-pyrrolidin-1-ylphenyl)benzamide
CID 110400397

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-4-morpholin-4-ylbenzamide?
The IUPAC name of N-(2,4-difluorophenyl)-4-morpholin-4-ylbenzamide (CID 53282259) is N-(2,4-difluorophenyl)-4-morpholin-4-ylbenzamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-4-morpholin-4-ylbenzamide?
The canonical SMILES for N-(2,4-difluorophenyl)-4-morpholin-4-ylbenzamide is O=C(Nc1ccc(F)cc1F)c1ccc(N2CCOCC2)cc1.
What is the InChIKey of N-(2,4-difluorophenyl)-4-morpholin-4-ylbenzamide?
The InChIKey is ORYIYQGWECVPOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16F2N2O2/c18-13-3-6-16(15(19)11-13)20-17(22)12-1-4-14(5-2-12)21-7-9-23-10-8-21/h1-6,11H,7-10H2,(H,20,22).
What are the key properties of N-(2,4-difluorophenyl)-4-morpholin-4-ylbenzamide?
N-(2,4-difluorophenyl)-4-morpholin-4-ylbenzamide has a molecular weight of 318.32 g/mol, XLogP of 3.05, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-4-morpholin-4-ylbenzamide is sourced from PubChem (CID 53282259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).