2-[(2-chloro-6-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(5-chloro-2-methoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2,5-dichlorophenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2,6-dimethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide

C100H85Cl4FN10O12 — CID 161453672

IUPAC2-[(2-chloro-6-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(5-chloro-2-methoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2,5-dichlorophenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2,6-dimethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide
SMILESCCOc1ccccc1COc1ccccc1C(=O)Nc1cccnc1.COc1ccc(Cl)cc1COc1ccccc1C(=O)Nc1cccnc1.Cc1cccc(C)c1COc1ccccc1C(=O)Nc1cccnc1.O=C(Nc1cccnc1)c1ccccc1OCc1c(F)cccc1Cl.O=C(Nc1cccnc1)c1ccccc1OCc1cc(Cl)ccc1Cl
InChIInChI=1S/C21H20N2O3.C21H20N2O2.C20H17ClN2O3.C19H14Cl2N2O2.C19H14ClFN2O2/c1-2-25-19-11-5-3-8-16(19)15-26-20-12-6-4-10-18(20)21(24)23-17-9-7-13-22-14-17;1-15-7-5-8-16(2)19(15)14-25-20-11-4-3-10-18(20)21(24)23-17-9-6-12-22-13-17;1-25-18-9-8-15(21)11-14(18)13-26-19-7-3-2-6-17(19)20(24)23-16-5-4-10-22-12-16;20-14-7-8-17(21)13(10-14)12-25-18-6-2-1-5-16(18)19(24)23-15-4-3-9-22-11-15;20-16-7-3-8-17(21)15(16)12-25-18-9-2-1-6-14(18)19(24)23-13-5-4-10-22-11-13/h3-14H,2,15H2,1H3,(H,23,24);3-13H,14H2,1-2H3,(H,23,24);2-12H,13H2,1H3,(H,23,24);2*1-11H,12H2,(H,23,24)
InChIKeyWAWCKWJPGJTKPZ-UHFFFAOYSA-N
MW1779.65 g/mol
LogP23.34
Rot. Bonds28

About 2-[(2-chloro-6-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(5-chloro-2-methoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2,5-dichlorophenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2,6-dimethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide

2-[(2-chloro-6-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(5-chloro-2-methoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2,5-dichlorophenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2,6-dimethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide (PubChem CID 161453672) has the molecular formula C100H85Cl4FN10O12 and a molecular weight of 1779.65 g/mol. Its IUPAC name is 2-[(2-chloro-6-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(5-chloro-2-methoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2,5-dichlorophenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2,6-dimethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide.

Molecular Properties

Compound Name2-[(2-chloro-6-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(5-chloro-2-methoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2,5-dichlorophenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2,6-dimethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide
PubChem CID161453672
Molecular FormulaC100H85Cl4FN10O12
Molecular Weight1779.65 g/mol
Exact Mass1776.51
IUPAC Name2-[(2-chloro-6-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(5-chloro-2-methoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2,5-dichlorophenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2,6-dimethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide
SMILESCCOc1ccccc1COc1ccccc1C(=O)Nc1cccnc1.COc1ccc(Cl)cc1COc1ccccc1C(=O)Nc1cccnc1.Cc1cccc(C)c1COc1ccccc1C(=O)Nc1cccnc1.O=C(Nc1cccnc1)c1ccccc1OCc1c(F)cccc1Cl.O=C(Nc1cccnc1)c1ccccc1OCc1cc(Cl)ccc1Cl
InChIInChI=1S/C21H20N2O3.C21H20N2O2.C20H17ClN2O3.C19H14Cl2N2O2.C19H14ClFN2O2/c1-2-25-19-11-5-3-8-16(19)15-26-20-12-6-4-10-18(20)21(24)23-17-9-7-13-22-14-17;1-15-7-5-8-16(2)19(15)14-25-20-11-4-3-10-18(20)21(24)23-17-9-6-12-22-13-17;1-25-18-9-8-15(21)11-14(18)13-26-19-7-3-2-6-17(19)20(24)23-16-5-4-10-22-12-16;20-14-7-8-17(21)13(10-14)12-25-18-6-2-1-5-16(18)19(24)23-15-4-3-9-22-11-15;20-16-7-3-8-17(21)15(16)12-25-18-9-2-1-6-14(18)19(24)23-13-5-4-10-22-11-13/h3-14H,2,15H2,1H3,(H,23,24);3-13H,14H2,1-2H3,(H,23,24);2-12H,13H2,1H3,(H,23,24);2*1-11H,12H2,(H,23,24)
InChIKeyWAWCKWJPGJTKPZ-UHFFFAOYSA-N
XLogP23.34
TPSA274.56 Ų
H-Bond Donors5
H-Bond Acceptors17
Rotatable Bonds28
Heavy Atoms127
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001779.65
LogP ≤ 523.34
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1017

Analyze 2-[(2-chloro-6-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(5-chloro-2-methoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2,5-dichlorophenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2,6-dimethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide with MolForge

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Related Compounds

2-[[2-(5-chloropentoxy)phenyl]methoxy]-N-pyridin-3-ylbenzamide
CID 118911752
2-[[5-chloro-2-(2-morpholin-4-ylethoxy)phenyl]methoxy]-N-pyridin-3-ylbenzamide
CID 118911706
2-[(2-nonylphenyl)methoxy]-N-pyridin-3-ylbenzamide
CID 118911692
2-[(3-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide
CID 118911652
2-[(4-methylphenyl)methoxy]-N-pyridin-3-ylbenzamide
CID 118911654
5-fluoro-2-methoxy-N-pyridin-3-ylbenzamide
CID 34947016
2-ethoxy-N-(3-methoxyphenyl)benzamide
CID 760215
4-chloro-2-ethoxy-N-(3-methoxyphenyl)benzamide
CID 17362963
N-[5-[(2,5-dichlorophenyl)methyl]-1,3-thiazol-2-yl]-2-ethoxybenzamide
CID 3891053
2-[4-[(2-chloro-6-fluorophenyl)methoxy]-3-methoxyphenyl]-N-(3-chlorophenyl)-1,3-thiazole-4-carboxamide
CID 46165555
3-chloro-4-ethoxy-5-methoxy-N-pyridin-3-ylbenzamide
CID 25343284
2-[(2-chlorophenyl)methoxy]-N'-(2-fluorobenzoyl)benzohydrazide
CID 26901785

Frequently Asked Questions

What is the IUPAC name of 2-[(2-chloro-6-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(5-chloro-2-methoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2,5-dichlorophenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2,6-dimethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide?
The IUPAC name of 2-[(2-chloro-6-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(5-chloro-2-methoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2,5-dichlorophenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2,6-dimethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide (CID 161453672) is 2-[(2-chloro-6-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(5-chloro-2-methoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2,5-dichlorophenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2,6-dimethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide.
What is the SMILES notation for 2-[(2-chloro-6-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(5-chloro-2-methoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2,5-dichlorophenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2,6-dimethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide?
The canonical SMILES for 2-[(2-chloro-6-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(5-chloro-2-methoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2,5-dichlorophenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2,6-dimethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide is CCOc1ccccc1COc1ccccc1C(=O)Nc1cccnc1.COc1ccc(Cl)cc1COc1ccccc1C(=O)Nc1cccnc1.Cc1cccc(C)c1COc1ccccc1C(=O)Nc1cccnc1.O=C(Nc1cccnc1)c1ccccc1OCc1c(F)cccc1Cl.O=C(Nc1cccnc1)c1ccccc1OCc1cc(Cl)ccc1Cl.
What is the InChIKey of 2-[(2-chloro-6-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(5-chloro-2-methoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2,5-dichlorophenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2,6-dimethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide?
The InChIKey is WAWCKWJPGJTKPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O3.C21H20N2O2.C20H17ClN2O3.C19H14Cl2N2O2.C19H14ClFN2O2/c1-2-25-19-11-5-3-8-16(19)15-26-20-12-6-4-10-18(20)21(24)23-17-9-7-13-22-14-17;1-15-7-5-8-16(2)19(15)14-25-20-11-4-3-10-18(20)21(24)23-17-9-6-12-22-13-17;1-25-18-9-8-15(21)11-14(18)13-26-19-7-3-2-6-17(19)20(24)23-16-5-4-10-22-12-16;20-14-7-8-17(21)13(10-14)12-25-18-6-2-1-5-16(18)19(24)23-15-4-3-9-22-11-15;20-16-7-3-8-17(21)15(16)12-25-18-9-2-1-6-14(18)19(24)23-13-5-4-10-22-11-13/h3-14H,2,15H2,1H3,(H,23,24);3-13H,14H2,1-2H3,(H,23,24);2-12H,13H2,1H3,(H,23,24);2*1-11H,12H2,(H,23,24).
What are the key properties of 2-[(2-chloro-6-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(5-chloro-2-methoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2,5-dichlorophenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2,6-dimethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide?
2-[(2-chloro-6-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(5-chloro-2-methoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2,5-dichlorophenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2,6-dimethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide has a molecular weight of 1779.65 g/mol, XLogP of 23.34, 28 rotatable bonds, 5 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-chloro-6-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(5-chloro-2-methoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2,5-dichlorophenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2,6-dimethylphenyl)methoxy]-N-pyridin-3-ylbenzamide;2-[(2-ethoxyphenyl)methoxy]-N-pyridin-3-ylbenzamide is sourced from PubChem (CID 161453672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).