5-chloro-2-fluoro-4-[(5-fluoro-2-pyridinyl)oxymethyl]benzamide

C13H9ClF2N2O2 — CID 172564376

IUPAC5-chloro-2-fluoro-4-[(5-fluoro-2-pyridinyl)oxymethyl]benzamide
SMILESNC(=O)c1cc(Cl)c(COc2ccc(F)cn2)cc1F
InChIInChI=1S/C13H9ClF2N2O2/c14-10-4-9(13(17)19)11(16)3-7(10)6-20-12-2-1-8(15)5-18-12/h1-5H,6H2,(H2,17,19)
InChIKeyQQQJHLPULWFKIG-UHFFFAOYSA-N
MW298.68 g/mol
LogP2.69
Rot. Bonds4

About 5-chloro-2-fluoro-4-[(5-fluoro-2-pyridinyl)oxymethyl]benzamide

5-chloro-2-fluoro-4-[(5-fluoro-2-pyridinyl)oxymethyl]benzamide (PubChem CID 172564376) has the molecular formula C13H9ClF2N2O2 and a molecular weight of 298.68 g/mol. Its IUPAC name is 5-chloro-2-fluoro-4-[(5-fluoro-2-pyridinyl)oxymethyl]benzamide.

Molecular Properties

Compound Name5-chloro-2-fluoro-4-[(5-fluoro-2-pyridinyl)oxymethyl]benzamide
PubChem CID172564376
Molecular FormulaC13H9ClF2N2O2
Molecular Weight298.68 g/mol
Exact Mass298.03
IUPAC Name5-chloro-2-fluoro-4-[(5-fluoro-2-pyridinyl)oxymethyl]benzamide
SMILESNC(=O)c1cc(Cl)c(COc2ccc(F)cn2)cc1F
InChIInChI=1S/C13H9ClF2N2O2/c14-10-4-9(13(17)19)11(16)3-7(10)6-20-12-2-1-8(15)5-18-12/h1-5H,6H2,(H2,17,19)
InChIKeyQQQJHLPULWFKIG-UHFFFAOYSA-N
XLogP2.69
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.68
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Nlx204; nlx204
CID 132256735
(3-Chloro-4-fluorophenyl)-[4-fluoro-4-[[2-[(4-methoxy-2-pyridinyl)oxy]ethylamino]methyl]piperidin-1-yl]methanone
CID 132256750
(3-Chloro-4-fluorophenyl)-[4-[[2-[(6-chloro-2-pyridinyl)oxy]ethylamino]methyl]-4-fluoropiperidin-1-yl]methanone
CID 132256754
(3-Chloro-4-fluorophenyl)-[4-fluoro-4-[[2-[(6-fluoro-2-pyridinyl)oxy]ethylamino]methyl]piperidin-1-yl]methanone
CID 132256755
(3-Chloro-4-fluorophenyl)-[4-fluoro-4-[[2-[(4-fluoro-2-pyridinyl)oxy]ethylamino]methyl]piperidin-1-yl]methanone
CID 132257041
(3-Chloro-4-fluorophenyl)-[4-fluoro-4-[[2-[(5-fluoro-2-pyridinyl)oxy]ethylamino]methyl]piperidin-1-yl]methanone
CID 132257105
(3-Chloro-4-fluorophenyl)-[4-fluoro-4-[[2-[4-(trifluoromethyl)pyridin-2-yl]oxyethylamino]methyl]piperidin-1-yl]methanone
CID 132257123
(3,4-Dichlorophenyl)-[4-fluoro-4-[(2-pyridin-2-yloxyethylamino)methyl]piperidin-1-yl]methanone
CID 132257275
N-[(2-chlorophenyl)methyl]-2-ethoxypyridine-3-carboxamide
CID 2574091
4-[(2-chlorophenoxy)methyl]-N-(3-pyridinylmethyl)benzamide
CID 2192193
N-(2,4-dichlorobenzyl)-6-(2,2,2-trifluoroethoxy)nicotinamide
CID 16725813
3-chloro-2,6-dimethyl-5-[6-[[4-(trifluoromethyl)phenyl]methoxy]pyridin-3-yl]-1H-pyridin-4-one
CID 57808485

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-fluoro-4-[(5-fluoro-2-pyridinyl)oxymethyl]benzamide?
The IUPAC name of 5-chloro-2-fluoro-4-[(5-fluoro-2-pyridinyl)oxymethyl]benzamide (CID 172564376) is 5-chloro-2-fluoro-4-[(5-fluoro-2-pyridinyl)oxymethyl]benzamide.
What is the SMILES notation for 5-chloro-2-fluoro-4-[(5-fluoro-2-pyridinyl)oxymethyl]benzamide?
The canonical SMILES for 5-chloro-2-fluoro-4-[(5-fluoro-2-pyridinyl)oxymethyl]benzamide is NC(=O)c1cc(Cl)c(COc2ccc(F)cn2)cc1F.
What is the InChIKey of 5-chloro-2-fluoro-4-[(5-fluoro-2-pyridinyl)oxymethyl]benzamide?
The InChIKey is QQQJHLPULWFKIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9ClF2N2O2/c14-10-4-9(13(17)19)11(16)3-7(10)6-20-12-2-1-8(15)5-18-12/h1-5H,6H2,(H2,17,19).
What are the key properties of 5-chloro-2-fluoro-4-[(5-fluoro-2-pyridinyl)oxymethyl]benzamide?
5-chloro-2-fluoro-4-[(5-fluoro-2-pyridinyl)oxymethyl]benzamide has a molecular weight of 298.68 g/mol, XLogP of 2.69, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-fluoro-4-[(5-fluoro-2-pyridinyl)oxymethyl]benzamide is sourced from PubChem (CID 172564376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).