2-fluoro-N-(5-fluoro-2-piperidin-1-ylphenyl)benzamide

C18H18F2N2O — CID 113092591

IUPAC2-fluoro-N-(5-fluoro-2-piperidin-1-ylphenyl)benzamide
SMILESO=C(Nc1cc(F)ccc1N1CCCCC1)c1ccccc1F
InChIInChI=1S/C18H18F2N2O/c19-13-8-9-17(22-10-4-1-5-11-22)16(12-13)21-18(23)14-6-2-3-7-15(14)20/h2-3,6-9,12H,1,4-5,10-11H2,(H,21,23)
InChIKeyBWNFJGZOEZMGJK-UHFFFAOYSA-N
MW316.35 g/mol
LogP4.21
Rot. Bonds3

About 2-fluoro-N-(5-fluoro-2-piperidin-1-ylphenyl)benzamide

2-fluoro-N-(5-fluoro-2-piperidin-1-ylphenyl)benzamide (PubChem CID 113092591) has the molecular formula C18H18F2N2O and a molecular weight of 316.35 g/mol. Its IUPAC name is 2-fluoro-N-(5-fluoro-2-piperidin-1-ylphenyl)benzamide.

Molecular Properties

Compound Name2-fluoro-N-(5-fluoro-2-piperidin-1-ylphenyl)benzamide
PubChem CID113092591
Molecular FormulaC18H18F2N2O
Molecular Weight316.35 g/mol
Exact Mass316.14
IUPAC Name2-fluoro-N-(5-fluoro-2-piperidin-1-ylphenyl)benzamide
SMILESO=C(Nc1cc(F)ccc1N1CCCCC1)c1ccccc1F
InChIInChI=1S/C18H18F2N2O/c19-13-8-9-17(22-10-4-1-5-11-22)16(12-13)21-18(23)14-6-2-3-7-15(14)20/h2-3,6-9,12H,1,4-5,10-11H2,(H,21,23)
InChIKeyBWNFJGZOEZMGJK-UHFFFAOYSA-N
XLogP4.21
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.35
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-fluoro-2-piperidin-1-ylphenyl)benzamide
CID 113092590
2-fluoro-N-(5-morpholin-4-yl-2-pyrrolidin-1-ylphenyl)benzamide
CID 110400396
N-(1,3-dimethyl-2-oxo-6-pyrrolidin-1-ylbenzimidazol-5-yl)-2-fluorobenzamide
CID 40642475
4-fluoro-N-(5-fluoro-2-pyrrolidin-1-ylphenyl)benzamide
CID 113092338
3-fluoro-N-(5-fluoro-2-pyrrolidin-1-ylphenyl)benzamide
CID 113092337
2-fluoro-N-[5-(morpholine-4-carbonyl)-2-pyrrolidin-1-ylphenyl]benzamide
CID 3953635
N-(5-fluoro-2-morpholin-4-ylphenyl)-2-methylbenzamide
CID 113092681
2-fluoro-N-[4-piperidin-1-yl-3-(pyrrolidine-1-carbonyl)phenyl]benzamide
CID 1055001
3-[(2-fluorobenzoyl)amino]-4-morpholin-4-ylbenzoic acid
CID 53052916
4-(4-cyclohexylpiperazin-1-yl)-3-[(2-fluorobenzoyl)amino]benzoic acid
CID 46285283
4-bromo-N-(5-fluoro-2-pyrrolidin-1-ylphenyl)benzamide
CID 113092341
N-(5-fluoro-2-pyrrolidin-1-ylphenyl)-4-(trifluoromethyl)benzamide
CID 113092377

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-(5-fluoro-2-piperidin-1-ylphenyl)benzamide?
The IUPAC name of 2-fluoro-N-(5-fluoro-2-piperidin-1-ylphenyl)benzamide (CID 113092591) is 2-fluoro-N-(5-fluoro-2-piperidin-1-ylphenyl)benzamide.
What is the SMILES notation for 2-fluoro-N-(5-fluoro-2-piperidin-1-ylphenyl)benzamide?
The canonical SMILES for 2-fluoro-N-(5-fluoro-2-piperidin-1-ylphenyl)benzamide is O=C(Nc1cc(F)ccc1N1CCCCC1)c1ccccc1F.
What is the InChIKey of 2-fluoro-N-(5-fluoro-2-piperidin-1-ylphenyl)benzamide?
The InChIKey is BWNFJGZOEZMGJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18F2N2O/c19-13-8-9-17(22-10-4-1-5-11-22)16(12-13)21-18(23)14-6-2-3-7-15(14)20/h2-3,6-9,12H,1,4-5,10-11H2,(H,21,23).
What are the key properties of 2-fluoro-N-(5-fluoro-2-piperidin-1-ylphenyl)benzamide?
2-fluoro-N-(5-fluoro-2-piperidin-1-ylphenyl)benzamide has a molecular weight of 316.35 g/mol, XLogP of 4.21, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-(5-fluoro-2-piperidin-1-ylphenyl)benzamide is sourced from PubChem (CID 113092591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).