N-(3-chlorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-[3-(1,1-difluoroethyl)phenyl]-6-(phenoxymethyl)pyridine-3-carboxamide;N-(2,3-difluorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(2-fluoro-4-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(3-fluoro-5-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(4-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide

C119H99ClF6N12O12 — CID 158595628

IUPACN-(3-chlorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-[3-(1,1-difluoroethyl)phenyl]-6-(phenoxymethyl)pyridine-3-carboxamide;N-(2,3-difluorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(2-fluoro-4-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(3-fluoro-5-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(4-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide
SMILESCC(F)(F)c1cccc(NC(=O)c2ccc(COc3ccccc3)nc2)c1.Cc1cc(F)cc(NC(=O)c2ccc(COc3ccccc3)nc2)c1.Cc1ccc(NC(=O)c2ccc(COc3ccccc3)nc2)c(F)c1.Cc1ccc(NC(=O)c2ccc(COc3ccccc3)nc2)cc1.O=C(Nc1cccc(Cl)c1)c1ccc(COc2ccccc2)nc1.O=C(Nc1cccc(F)c1F)c1ccc(COc2ccccc2)nc1
InChIInChI=1S/C21H18F2N2O2.2C20H17FN2O2.C20H18N2O2.C19H15ClN2O2.C19H14F2N2O2/c1-21(22,23)16-6-5-7-17(12-16)25-20(26)15-10-11-18(24-13-15)14-27-19-8-3-2-4-9-19;1-14-7-10-19(18(21)11-14)23-20(24)15-8-9-16(22-12-15)13-25-17-5-3-2-4-6-17;1-14-9-16(21)11-18(10-14)23-20(24)15-7-8-17(22-12-15)13-25-19-5-3-2-4-6-19;1-15-7-10-17(11-8-15)22-20(23)16-9-12-18(21-13-16)14-24-19-5-3-2-4-6-19;20-15-5-4-6-16(11-15)22-19(23)14-9-10-17(21-12-14)13-24-18-7-2-1-3-8-18;20-16-7-4-8-17(18(16)21)23-19(24)13-9-10-14(22-11-13)12-25-15-5-2-1-3-6-15/h2-13H,14H2,1H3,(H,25,26);2*2-12H,13H2,1H3,(H,23,24);2-13H,14H2,1H3,(H,22,23);1-12H,13H2,(H,22,23);1-11H,12H2,(H,23,24)
InChIKeyHUZMFEPDHGVCGH-UHFFFAOYSA-N
MW2038.61 g/mol
LogP26.72
Rot. Bonds31

About N-(3-chlorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-[3-(1,1-difluoroethyl)phenyl]-6-(phenoxymethyl)pyridine-3-carboxamide;N-(2,3-difluorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(2-fluoro-4-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(3-fluoro-5-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(4-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide

N-(3-chlorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-[3-(1,1-difluoroethyl)phenyl]-6-(phenoxymethyl)pyridine-3-carboxamide;N-(2,3-difluorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(2-fluoro-4-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(3-fluoro-5-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(4-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide (PubChem CID 158595628) has the molecular formula C119H99ClF6N12O12 and a molecular weight of 2038.61 g/mol. Its IUPAC name is N-(3-chlorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-[3-(1,1-difluoroethyl)phenyl]-6-(phenoxymethyl)pyridine-3-carboxamide;N-(2,3-difluorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(2-fluoro-4-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(3-fluoro-5-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(4-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-[3-(1,1-difluoroethyl)phenyl]-6-(phenoxymethyl)pyridine-3-carboxamide;N-(2,3-difluorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(2-fluoro-4-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(3-fluoro-5-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(4-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide
PubChem CID158595628
Molecular FormulaC119H99ClF6N12O12
Molecular Weight2038.61 g/mol
Exact Mass2036.71
IUPAC NameN-(3-chlorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-[3-(1,1-difluoroethyl)phenyl]-6-(phenoxymethyl)pyridine-3-carboxamide;N-(2,3-difluorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(2-fluoro-4-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(3-fluoro-5-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(4-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide
SMILESCC(F)(F)c1cccc(NC(=O)c2ccc(COc3ccccc3)nc2)c1.Cc1cc(F)cc(NC(=O)c2ccc(COc3ccccc3)nc2)c1.Cc1ccc(NC(=O)c2ccc(COc3ccccc3)nc2)c(F)c1.Cc1ccc(NC(=O)c2ccc(COc3ccccc3)nc2)cc1.O=C(Nc1cccc(Cl)c1)c1ccc(COc2ccccc2)nc1.O=C(Nc1cccc(F)c1F)c1ccc(COc2ccccc2)nc1
InChIInChI=1S/C21H18F2N2O2.2C20H17FN2O2.C20H18N2O2.C19H15ClN2O2.C19H14F2N2O2/c1-21(22,23)16-6-5-7-17(12-16)25-20(26)15-10-11-18(24-13-15)14-27-19-8-3-2-4-9-19;1-14-7-10-19(18(21)11-14)23-20(24)15-8-9-16(22-12-15)13-25-17-5-3-2-4-6-17;1-14-9-16(21)11-18(10-14)23-20(24)15-7-8-17(22-12-15)13-25-19-5-3-2-4-6-19;1-15-7-10-17(11-8-15)22-20(23)16-9-12-18(21-13-16)14-24-19-5-3-2-4-6-19;20-15-5-4-6-16(11-15)22-19(23)14-9-10-17(21-12-14)13-24-18-7-2-1-3-8-18;20-16-7-4-8-17(18(16)21)23-19(24)13-9-10-14(22-11-13)12-25-15-5-2-1-3-6-15/h2-13H,14H2,1H3,(H,25,26);2*2-12H,13H2,1H3,(H,23,24);2-13H,14H2,1H3,(H,22,23);1-12H,13H2,(H,22,23);1-11H,12H2,(H,23,24)
InChIKeyHUZMFEPDHGVCGH-UHFFFAOYSA-N
XLogP26.72
TPSA307.32 Ų
H-Bond Donors6
H-Bond Acceptors18
Rotatable Bonds31
Heavy Atoms150
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002038.61
LogP ≤ 526.72
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1018

Analyze N-(3-chlorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-[3-(1,1-difluoroethyl)phenyl]-6-(phenoxymethyl)pyridine-3-carboxamide;N-(2,3-difluorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(2-fluoro-4-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(3-fluoro-5-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(4-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide with MolForge

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Related Compounds

N-[4-chloro-3-[5-(2,2,2-trifluoroethoxy)-2-pyridinyl]phenyl]-6-(fluoromethyl)-2-methylpyridine-3-carboxamide
CID 118018153
bis(N-[4-chloro-3-(5-ethoxy-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide);N-[4-chloro-3-(5-hydroxy-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;bis(N-[4-chloro-3-(5-methoxy-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide)
CID 123343601
6-[(5-chloro-3-pyridinyl)oxymethyl]-N-[1-[4-[3-[[5-(1-cyclohexylethylcarbamoyl)-2-pyridinyl]methoxy]-5-(trifluoromethyl)pyridin-1-ium-1-yl]cyclohexyl]ethyl]pyridine-3-carboxamide
CID 123525877
N-(4-chloro-3-pyridin-2-ylphenyl)-2,6-dimethyl-N-[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]pyridine-3-carboxamide;N-(4-chloro-3-pyridin-2-ylphenyl)-3-methoxy-5-methylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide
CID 123818813
6-[(3-fluorophenoxy)methyl]-N-(1-pyridin-2-ylcyclopropyl)pyridine-3-carboxamide;6-[(3-fluorophenoxy)methyl]-N-[2,2,2-trifluoro-1-(4-fluorophenyl)ethyl]pyridine-3-carboxamide
CID 144288057
N-[4-chloro-3-(5-ethoxy-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-[4-chloro-3-(4-ethyl-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;bis(N-[4-chloro-3-(5-methoxy-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide);N-[4-chloro-3-[5-(2,2,2-trifluoroethoxy)-2-pyridinyl]phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide
CID 157055431
N-(3-chloro-5-pyridin-3-yloxyphenyl)-3-methylbenzamide;N-(3-fluoro-5-pyridin-3-yloxyphenyl)-3-methylbenzamide;N-(3-iodo-5-pyridin-3-yloxyphenyl)-3-methylbenzamide;6-methyl-N-(3-pyridin-3-yloxyphenyl)pyridine-2-carboxamide;3-methyl-N-[3-pyridin-3-yloxy-5-(trifluoromethyl)phenyl]benzamide
CID 157269543
2-chloro-6-methyl-N-[4-[(2S)-morpholin-2-yl]phenyl]pyridine-4-carboxamide;2-chloro-6-methyl-N-[4-[(2R)-morpholin-2-yl]phenyl]pyridine-4-carboxamide;N-[4-[(2S)-morpholin-2-yl]phenyl]-6-(trifluoromethyl)pyridine-3-carboxamide
CID 157374951
N-[4-chloro-3-(5-ethoxy-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-[4-chloro-3-(4-ethyl-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-[4-chloro-3-(5-fluoro-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-[4-chloro-3-[5-(2,2,2-trifluoroethoxy)-2-pyridinyl]phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide
CID 157568675
N-[4-chloro-3-(5-chloro-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-[4-chloro-3-(6-chloro-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-[4-chloro-3-(5-hydroxy-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-[4-chloro-3-(5-methoxy-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-[4-chloro-3-(5-methyl-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide
CID 157829701
N-(3-chloro-5-pyridin-3-yloxyphenyl)-3-methylbenzamide;3-(1,1-difluoroethyl)-N-(3-pyridin-3-yloxyphenyl)benzamide;N-(3-fluoro-5-pyridin-3-yloxyphenyl)-3-methylbenzamide;N-(3-iodo-5-pyridin-3-yloxyphenyl)-3-methylbenzamide;methane;3-methoxy-N-(3-pyridin-3-yloxyphenyl)benzamide
CID 158130057
(4S)-1-(4-amino-3-pyridinyl)-4-hydroxypentan-1-one;4-chloro-2-[2-fluoro-5-(trifluoromethoxy)phenyl]-5-prop-1-en-2-ylpyridine;2,4-dichloro-5-prop-1-en-2-ylpyridine;[2-fluoro-5-(trifluoromethoxy)phenyl]boronic acid;4-[[2-[2-fluoro-5-(trifluoromethoxy)phenyl]-5-prop-1-en-2-yl-4-pyridinyl]amino]-N-[(2S)-2-hydroxypropyl]pyridine-3-carboxamide
CID 158208243

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-[3-(1,1-difluoroethyl)phenyl]-6-(phenoxymethyl)pyridine-3-carboxamide;N-(2,3-difluorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(2-fluoro-4-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(3-fluoro-5-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(4-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide?
The IUPAC name of N-(3-chlorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-[3-(1,1-difluoroethyl)phenyl]-6-(phenoxymethyl)pyridine-3-carboxamide;N-(2,3-difluorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(2-fluoro-4-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(3-fluoro-5-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(4-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide (CID 158595628) is N-(3-chlorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-[3-(1,1-difluoroethyl)phenyl]-6-(phenoxymethyl)pyridine-3-carboxamide;N-(2,3-difluorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(2-fluoro-4-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(3-fluoro-5-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(4-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide.
What is the SMILES notation for N-(3-chlorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-[3-(1,1-difluoroethyl)phenyl]-6-(phenoxymethyl)pyridine-3-carboxamide;N-(2,3-difluorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(2-fluoro-4-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(3-fluoro-5-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(4-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide?
The canonical SMILES for N-(3-chlorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-[3-(1,1-difluoroethyl)phenyl]-6-(phenoxymethyl)pyridine-3-carboxamide;N-(2,3-difluorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(2-fluoro-4-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(3-fluoro-5-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(4-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide is CC(F)(F)c1cccc(NC(=O)c2ccc(COc3ccccc3)nc2)c1.Cc1cc(F)cc(NC(=O)c2ccc(COc3ccccc3)nc2)c1.Cc1ccc(NC(=O)c2ccc(COc3ccccc3)nc2)c(F)c1.Cc1ccc(NC(=O)c2ccc(COc3ccccc3)nc2)cc1.O=C(Nc1cccc(Cl)c1)c1ccc(COc2ccccc2)nc1.O=C(Nc1cccc(F)c1F)c1ccc(COc2ccccc2)nc1.
What is the InChIKey of N-(3-chlorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-[3-(1,1-difluoroethyl)phenyl]-6-(phenoxymethyl)pyridine-3-carboxamide;N-(2,3-difluorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(2-fluoro-4-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(3-fluoro-5-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(4-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide?
The InChIKey is HUZMFEPDHGVCGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18F2N2O2.2C20H17FN2O2.C20H18N2O2.C19H15ClN2O2.C19H14F2N2O2/c1-21(22,23)16-6-5-7-17(12-16)25-20(26)15-10-11-18(24-13-15)14-27-19-8-3-2-4-9-19;1-14-7-10-19(18(21)11-14)23-20(24)15-8-9-16(22-12-15)13-25-17-5-3-2-4-6-17;1-14-9-16(21)11-18(10-14)23-20(24)15-7-8-17(22-12-15)13-25-19-5-3-2-4-6-19;1-15-7-10-17(11-8-15)22-20(23)16-9-12-18(21-13-16)14-24-19-5-3-2-4-6-19;20-15-5-4-6-16(11-15)22-19(23)14-9-10-17(21-12-14)13-24-18-7-2-1-3-8-18;20-16-7-4-8-17(18(16)21)23-19(24)13-9-10-14(22-11-13)12-25-15-5-2-1-3-6-15/h2-13H,14H2,1H3,(H,25,26);2*2-12H,13H2,1H3,(H,23,24);2-13H,14H2,1H3,(H,22,23);1-12H,13H2,(H,22,23);1-11H,12H2,(H,23,24).
What are the key properties of N-(3-chlorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-[3-(1,1-difluoroethyl)phenyl]-6-(phenoxymethyl)pyridine-3-carboxamide;N-(2,3-difluorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(2-fluoro-4-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(3-fluoro-5-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(4-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide?
N-(3-chlorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-[3-(1,1-difluoroethyl)phenyl]-6-(phenoxymethyl)pyridine-3-carboxamide;N-(2,3-difluorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(2-fluoro-4-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(3-fluoro-5-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(4-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide has a molecular weight of 2038.61 g/mol, XLogP of 26.72, 31 rotatable bonds, 6 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-[3-(1,1-difluoroethyl)phenyl]-6-(phenoxymethyl)pyridine-3-carboxamide;N-(2,3-difluorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(2-fluoro-4-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(3-fluoro-5-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide;N-(4-methylphenyl)-6-(phenoxymethyl)pyridine-3-carboxamide is sourced from PubChem (CID 158595628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).