2-(4-cyclopropylphenoxy)-3-(4-methoxy-3-pyridinyl)pyridine;ethyl 4-[[3-(4-methoxy-3-pyridinyl)-2-pyridinyl]oxy]benzoate;2-(4-ethylphenoxy)-3-(4-methoxy-3-pyridinyl)pyridine;3-(4-methoxy-3-pyridinyl)-2-(4-methylphenoxy)pyridine;3-(4-methoxy-3-pyridinyl)-2-[4-(trifluoromethoxy)phenoxy]pyridine;2-methoxy-3-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)-3-pyridinyl]pyridine

C116H103F3N12O15 — CID 158565670

IUPAC2-(4-cyclopropylphenoxy)-3-(4-methoxy-3-pyridinyl)pyridine;ethyl 4-[[3-(4-methoxy-3-pyridinyl)-2-pyridinyl]oxy]benzoate;2-(4-ethylphenoxy)-3-(4-methoxy-3-pyridinyl)pyridine;3-(4-methoxy-3-pyridinyl)-2-(4-methylphenoxy)pyridine;3-(4-methoxy-3-pyridinyl)-2-[4-(trifluoromethoxy)phenoxy]pyridine;2-methoxy-3-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)-3-pyridinyl]pyridine
SMILESCCOC(=O)c1ccc(Oc2ncccc2-c2cnccc2OC)cc1.CCc1ccc(Oc2ncccc2-c2cnccc2OC)cc1.COc1ccncc1-c1cccnc1Oc1ccc(C)cc1.COc1ccncc1-c1cccnc1Oc1ccc(C2CC2)cc1.COc1ccncc1-c1cccnc1Oc1ccc(OC(F)(F)F)cc1.COc1ncccc1-c1cccnc1Oc1ccc2c(c1)CCCC2
InChIInChI=1S/C21H20N2O2.C20H18N2O4.C20H18N2O2.C19H18N2O2.C18H13F3N2O3.C18H16N2O2/c1-24-20-18(8-4-12-22-20)19-9-5-13-23-21(19)25-17-11-10-15-6-2-3-7-16(15)14-17;1-3-25-20(23)14-6-8-15(9-7-14)26-19-16(5-4-11-22-19)17-13-21-12-10-18(17)24-2;1-23-19-10-12-21-13-18(19)17-3-2-11-22-20(17)24-16-8-6-15(7-9-16)14-4-5-14;1-3-14-6-8-15(9-7-14)23-19-16(5-4-11-21-19)17-13-20-12-10-18(17)22-2;1-24-16-8-10-22-11-15(16)14-3-2-9-23-17(14)25-12-4-6-13(7-5-12)26-18(19,20)21;1-13-5-7-14(8-6-13)22-18-15(4-3-10-20-18)16-12-19-11-9-17(16)21-2/h4-5,8-14H,2-3,6-7H2,1H3;4-13H,3H2,1-2H3;2-3,6-14H,4-5H2,1H3;4-13H,3H2,1-2H3;2-11H,1H3;3-12H,1-2H3
InChIKeyHRLCYGIOOFZOPA-UHFFFAOYSA-N
MW1962.16 g/mol
LogP27.37
Rot. Bonds29

About 2-(4-cyclopropylphenoxy)-3-(4-methoxy-3-pyridinyl)pyridine;ethyl 4-[[3-(4-methoxy-3-pyridinyl)-2-pyridinyl]oxy]benzoate;2-(4-ethylphenoxy)-3-(4-methoxy-3-pyridinyl)pyridine;3-(4-methoxy-3-pyridinyl)-2-(4-methylphenoxy)pyridine;3-(4-methoxy-3-pyridinyl)-2-[4-(trifluoromethoxy)phenoxy]pyridine;2-methoxy-3-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)-3-pyridinyl]pyridine

2-(4-cyclopropylphenoxy)-3-(4-methoxy-3-pyridinyl)pyridine;ethyl 4-[[3-(4-methoxy-3-pyridinyl)-2-pyridinyl]oxy]benzoate;2-(4-ethylphenoxy)-3-(4-methoxy-3-pyridinyl)pyridine;3-(4-methoxy-3-pyridinyl)-2-(4-methylphenoxy)pyridine;3-(4-methoxy-3-pyridinyl)-2-[4-(trifluoromethoxy)phenoxy]pyridine;2-methoxy-3-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)-3-pyridinyl]pyridine (PubChem CID 158565670) has the molecular formula C116H103F3N12O15 and a molecular weight of 1962.16 g/mol. Its IUPAC name is 2-(4-cyclopropylphenoxy)-3-(4-methoxy-3-pyridinyl)pyridine;ethyl 4-[[3-(4-methoxy-3-pyridinyl)-2-pyridinyl]oxy]benzoate;2-(4-ethylphenoxy)-3-(4-methoxy-3-pyridinyl)pyridine;3-(4-methoxy-3-pyridinyl)-2-(4-methylphenoxy)pyridine;3-(4-methoxy-3-pyridinyl)-2-[4-(trifluoromethoxy)phenoxy]pyridine;2-methoxy-3-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)-3-pyridinyl]pyridine.

Molecular Properties

Compound Name2-(4-cyclopropylphenoxy)-3-(4-methoxy-3-pyridinyl)pyridine;ethyl 4-[[3-(4-methoxy-3-pyridinyl)-2-pyridinyl]oxy]benzoate;2-(4-ethylphenoxy)-3-(4-methoxy-3-pyridinyl)pyridine;3-(4-methoxy-3-pyridinyl)-2-(4-methylphenoxy)pyridine;3-(4-methoxy-3-pyridinyl)-2-[4-(trifluoromethoxy)phenoxy]pyridine;2-methoxy-3-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)-3-pyridinyl]pyridine
PubChem CID158565670
Molecular FormulaC116H103F3N12O15
Molecular Weight1962.16 g/mol
Exact Mass1960.76
IUPAC Name2-(4-cyclopropylphenoxy)-3-(4-methoxy-3-pyridinyl)pyridine;ethyl 4-[[3-(4-methoxy-3-pyridinyl)-2-pyridinyl]oxy]benzoate;2-(4-ethylphenoxy)-3-(4-methoxy-3-pyridinyl)pyridine;3-(4-methoxy-3-pyridinyl)-2-(4-methylphenoxy)pyridine;3-(4-methoxy-3-pyridinyl)-2-[4-(trifluoromethoxy)phenoxy]pyridine;2-methoxy-3-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)-3-pyridinyl]pyridine
SMILESCCOC(=O)c1ccc(Oc2ncccc2-c2cnccc2OC)cc1.CCc1ccc(Oc2ncccc2-c2cnccc2OC)cc1.COc1ccncc1-c1cccnc1Oc1ccc(C)cc1.COc1ccncc1-c1cccnc1Oc1ccc(C2CC2)cc1.COc1ccncc1-c1cccnc1Oc1ccc(OC(F)(F)F)cc1.COc1ncccc1-c1cccnc1Oc1ccc2c(c1)CCCC2
InChIInChI=1S/C21H20N2O2.C20H18N2O4.C20H18N2O2.C19H18N2O2.C18H13F3N2O3.C18H16N2O2/c1-24-20-18(8-4-12-22-20)19-9-5-13-23-21(19)25-17-11-10-15-6-2-3-7-16(15)14-17;1-3-25-20(23)14-6-8-15(9-7-14)26-19-16(5-4-11-22-19)17-13-21-12-10-18(17)24-2;1-23-19-10-12-21-13-18(19)17-3-2-11-22-20(17)24-16-8-6-15(7-9-16)14-4-5-14;1-3-14-6-8-15(9-7-14)23-19-16(5-4-11-21-19)17-13-20-12-10-18(17)22-2;1-24-16-8-10-22-11-15(16)14-3-2-9-23-17(14)25-12-4-6-13(7-5-12)26-18(19,20)21;1-13-5-7-14(8-6-13)22-18-15(4-3-10-20-18)16-12-19-11-9-17(16)21-2/h4-5,8-14H,2-3,6-7H2,1H3;4-13H,3H2,1-2H3;2-3,6-14H,4-5H2,1H3;4-13H,3H2,1-2H3;2-11H,1H3;3-12H,1-2H3
InChIKeyHRLCYGIOOFZOPA-UHFFFAOYSA-N
XLogP27.37
TPSA300.97 Ų
H-Bond Donors
H-Bond Acceptors27
Rotatable Bonds29
Heavy Atoms146
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001962.16
LogP ≤ 527.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1027

Analyze 2-(4-cyclopropylphenoxy)-3-(4-methoxy-3-pyridinyl)pyridine;ethyl 4-[[3-(4-methoxy-3-pyridinyl)-2-pyridinyl]oxy]benzoate;2-(4-ethylphenoxy)-3-(4-methoxy-3-pyridinyl)pyridine;3-(4-methoxy-3-pyridinyl)-2-(4-methylphenoxy)pyridine;3-(4-methoxy-3-pyridinyl)-2-[4-(trifluoromethoxy)phenoxy]pyridine;2-methoxy-3-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)-3-pyridinyl]pyridine with MolForge

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Launch Full Analysis

Related Compounds

1-[[3,5-Bis(phenylmethoxy)phenyl]methyl]-4-[1-[[3,5-bis(phenylmethoxy)phenyl]methyl]pyridin-1-ium-4-yl]pyridin-1-ium;1-[(3,5-dimethoxyphenyl)methyl]-4-[1-[(3,5-dimethoxyphenyl)methyl]pyridin-1-ium-4-yl]pyridin-1-ium;1-[(3,5-dimethoxyphenyl)methyl]-4-[1-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]pyridin-1-ium-4-yl]pyridin-1-ium;methyl 4-[[4-[1-[(4-methoxycarbonylphenyl)methyl]pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]methyl]benzoate
CID 158619126
Formaldehyde;1-[4-(4-methylcyclohexyl)cyclohexyl]oxy-4-(2,2,2-trifluoroethoxy)benzene;(6-methylnaphthalen-2-yl) 4-decoxybenzoate;(4-methylnaphthalen-1-yl) 4-octoxybenzoate;(4-methylphenyl) 6-decoxypyridine-3-carboxylate;(4-methylphenyl) 4-(4-decylphenyl)benzoate;(4-methylphenyl) 4-(4-methylcyclohexyl)cyclohexane-1-carboxylate;bis((4-methylphenyl) 6-(4-methylhexoxy)pyridine-3-carboxylate);bis((4-methylphenyl)-(5-octoxynaphthalen-1-yl)methanone);(4-methylphenyl) 4-(4-pentylcyclohexyl)benzoate
CID 160258035
methyl 3-[2-[(1S)-6-(3,3,3-trifluoropropoxy)-1,2,3,4-tetrahydronaphthalen-1-yl]ethyl]pyridine-4-carboxylate;methyl 3-[2-[(1R)-6-(3,3,3-trifluoropropoxy)-1,2,3,4-tetrahydronaphthalen-1-yl]ethyl]pyridine-4-carboxylate
CID 160397671
3-[2-(6,7-dimethyl-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-[7-(furan-3-yl)-3,4-dihydro-2H-chromen-4-yl]ethyl]pyridine-4-carboxylic acid;3-[2-[7-(3-methylphenyl)-3,4-dihydro-2H-chromen-4-yl]ethyl]pyridine-4-carboxylic acid;3-[2-[7-(4-methylphenyl)-3,4-dihydro-2H-chromen-4-yl]ethyl]pyridine-4-carboxylic acid;3-[2-[6-[(6-methyl-2-pyridinyl)oxy]-1,2,3,4-tetrahydronaphthalen-1-yl]ethyl]pyridine-4-carboxylic acid;3-[2-(7-phenoxy-3,4-dihydro-2H-chromen-4-yl)ethyl]pyridine-4-carboxylic acid;3-[2-[7-[4-(trifluoromethyl)phenyl]-3,4-dihydro-2H-chromen-4-yl]ethyl]pyridine-4-carboxylic acid
CID 160866651
4-[(4-Carboxyphenoxy)methyl]piperidine-1-carboxylic acid;[4-[[5-(trifluoromethyl)pyridin-2-yl]methyl]phenyl] 4-[4-(5-methylpyridin-2-yl)oxyphenoxy]piperidine-1-carboxylate
CID 161473801
[6-(Trifluoromethoxy)-3-pyridinyl] 4-butoxybenzoate;[6-(trifluoromethoxy)-3-pyridinyl] 4-ethoxybenzoate;[6-(trifluoromethoxy)-3-pyridinyl] 4-heptoxybenzoate;[6-(trifluoromethoxy)-3-pyridinyl] 4-hexoxybenzoate;[6-(trifluoromethoxy)-3-pyridinyl] 4-octoxybenzoate;[6-(trifluoromethoxy)-3-pyridinyl] 4-pentoxybenzoate;[6-(trifluoromethoxy)-3-pyridinyl] 4-propoxybenzoate
CID 173372522
Nonakis(pyridine);bis(25,26,27,28-tetrapropoxypentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(24),3,5,7(28),9,11,13(27),15(26),16,18,21(25),22-dodecaene-5,11,17,23-tetracarboxylic acid)
CID 139161050
4-(4-Pyridin-2-yloxyphenoxy)piperidine-1-carboxylic acid;4-[1-[4-[[5-(trifluoromethyl)pyridin-2-yl]methyl]phenoxy]carbonylpiperidin-4-yl]oxybenzoic acid
CID 157771403
4-[(4-Carboxyphenoxy)methyl]piperidine-1-carboxylic acid;[4-[[4-(trifluoromethyl)phenyl]methyl]phenyl] 4-[4-(5-methylpyridin-2-yl)oxyphenoxy]piperidine-1-carboxylate
CID 158935993
[6-(Trifluoromethoxy)pyridin-3-yl] 4-heptoxybenzoate;[6-(trifluoromethoxy)pyridin-3-yl] 4-hexoxybenzoate;[6-(trifluoromethoxy)pyridin-3-yl] 4-octoxybenzoate
CID 162253756
[3-[3-[3,5-Bis(3-pyridin-3-ylphenyl)phenyl]phenyl]phenyl] 3-[[3-[3-[3,5-bis(3-pyridin-3-ylphenyl)phenyl]phenyl]phenyl]peroxymethyl]benzoate
CID 57968084
[4-[4-[4-[4-(4-Ethylcyclohexanecarbonyl)oxybenzoyl]oxycyclohexanecarbonyl]oxy-6-pyridin-3-ylnaphthalen-1-yl]oxycarbonylcyclohexyl] 4-(4-ethylcyclohexanecarbonyl)oxybenzoate
CID 118359487

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyclopropylphenoxy)-3-(4-methoxy-3-pyridinyl)pyridine;ethyl 4-[[3-(4-methoxy-3-pyridinyl)-2-pyridinyl]oxy]benzoate;2-(4-ethylphenoxy)-3-(4-methoxy-3-pyridinyl)pyridine;3-(4-methoxy-3-pyridinyl)-2-(4-methylphenoxy)pyridine;3-(4-methoxy-3-pyridinyl)-2-[4-(trifluoromethoxy)phenoxy]pyridine;2-methoxy-3-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)-3-pyridinyl]pyridine?
The IUPAC name of 2-(4-cyclopropylphenoxy)-3-(4-methoxy-3-pyridinyl)pyridine;ethyl 4-[[3-(4-methoxy-3-pyridinyl)-2-pyridinyl]oxy]benzoate;2-(4-ethylphenoxy)-3-(4-methoxy-3-pyridinyl)pyridine;3-(4-methoxy-3-pyridinyl)-2-(4-methylphenoxy)pyridine;3-(4-methoxy-3-pyridinyl)-2-[4-(trifluoromethoxy)phenoxy]pyridine;2-methoxy-3-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)-3-pyridinyl]pyridine (CID 158565670) is 2-(4-cyclopropylphenoxy)-3-(4-methoxy-3-pyridinyl)pyridine;ethyl 4-[[3-(4-methoxy-3-pyridinyl)-2-pyridinyl]oxy]benzoate;2-(4-ethylphenoxy)-3-(4-methoxy-3-pyridinyl)pyridine;3-(4-methoxy-3-pyridinyl)-2-(4-methylphenoxy)pyridine;3-(4-methoxy-3-pyridinyl)-2-[4-(trifluoromethoxy)phenoxy]pyridine;2-methoxy-3-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)-3-pyridinyl]pyridine.
What is the SMILES notation for 2-(4-cyclopropylphenoxy)-3-(4-methoxy-3-pyridinyl)pyridine;ethyl 4-[[3-(4-methoxy-3-pyridinyl)-2-pyridinyl]oxy]benzoate;2-(4-ethylphenoxy)-3-(4-methoxy-3-pyridinyl)pyridine;3-(4-methoxy-3-pyridinyl)-2-(4-methylphenoxy)pyridine;3-(4-methoxy-3-pyridinyl)-2-[4-(trifluoromethoxy)phenoxy]pyridine;2-methoxy-3-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)-3-pyridinyl]pyridine?
The canonical SMILES for 2-(4-cyclopropylphenoxy)-3-(4-methoxy-3-pyridinyl)pyridine;ethyl 4-[[3-(4-methoxy-3-pyridinyl)-2-pyridinyl]oxy]benzoate;2-(4-ethylphenoxy)-3-(4-methoxy-3-pyridinyl)pyridine;3-(4-methoxy-3-pyridinyl)-2-(4-methylphenoxy)pyridine;3-(4-methoxy-3-pyridinyl)-2-[4-(trifluoromethoxy)phenoxy]pyridine;2-methoxy-3-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)-3-pyridinyl]pyridine is CCOC(=O)c1ccc(Oc2ncccc2-c2cnccc2OC)cc1.CCc1ccc(Oc2ncccc2-c2cnccc2OC)cc1.COc1ccncc1-c1cccnc1Oc1ccc(C)cc1.COc1ccncc1-c1cccnc1Oc1ccc(C2CC2)cc1.COc1ccncc1-c1cccnc1Oc1ccc(OC(F)(F)F)cc1.COc1ncccc1-c1cccnc1Oc1ccc2c(c1)CCCC2.
What is the InChIKey of 2-(4-cyclopropylphenoxy)-3-(4-methoxy-3-pyridinyl)pyridine;ethyl 4-[[3-(4-methoxy-3-pyridinyl)-2-pyridinyl]oxy]benzoate;2-(4-ethylphenoxy)-3-(4-methoxy-3-pyridinyl)pyridine;3-(4-methoxy-3-pyridinyl)-2-(4-methylphenoxy)pyridine;3-(4-methoxy-3-pyridinyl)-2-[4-(trifluoromethoxy)phenoxy]pyridine;2-methoxy-3-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)-3-pyridinyl]pyridine?
The InChIKey is HRLCYGIOOFZOPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O2.C20H18N2O4.C20H18N2O2.C19H18N2O2.C18H13F3N2O3.C18H16N2O2/c1-24-20-18(8-4-12-22-20)19-9-5-13-23-21(19)25-17-11-10-15-6-2-3-7-16(15)14-17;1-3-25-20(23)14-6-8-15(9-7-14)26-19-16(5-4-11-22-19)17-13-21-12-10-18(17)24-2;1-23-19-10-12-21-13-18(19)17-3-2-11-22-20(17)24-16-8-6-15(7-9-16)14-4-5-14;1-3-14-6-8-15(9-7-14)23-19-16(5-4-11-21-19)17-13-20-12-10-18(17)22-2;1-24-16-8-10-22-11-15(16)14-3-2-9-23-17(14)25-12-4-6-13(7-5-12)26-18(19,20)21;1-13-5-7-14(8-6-13)22-18-15(4-3-10-20-18)16-12-19-11-9-17(16)21-2/h4-5,8-14H,2-3,6-7H2,1H3;4-13H,3H2,1-2H3;2-3,6-14H,4-5H2,1H3;4-13H,3H2,1-2H3;2-11H,1H3;3-12H,1-2H3.
What are the key properties of 2-(4-cyclopropylphenoxy)-3-(4-methoxy-3-pyridinyl)pyridine;ethyl 4-[[3-(4-methoxy-3-pyridinyl)-2-pyridinyl]oxy]benzoate;2-(4-ethylphenoxy)-3-(4-methoxy-3-pyridinyl)pyridine;3-(4-methoxy-3-pyridinyl)-2-(4-methylphenoxy)pyridine;3-(4-methoxy-3-pyridinyl)-2-[4-(trifluoromethoxy)phenoxy]pyridine;2-methoxy-3-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)-3-pyridinyl]pyridine?
2-(4-cyclopropylphenoxy)-3-(4-methoxy-3-pyridinyl)pyridine;ethyl 4-[[3-(4-methoxy-3-pyridinyl)-2-pyridinyl]oxy]benzoate;2-(4-ethylphenoxy)-3-(4-methoxy-3-pyridinyl)pyridine;3-(4-methoxy-3-pyridinyl)-2-(4-methylphenoxy)pyridine;3-(4-methoxy-3-pyridinyl)-2-[4-(trifluoromethoxy)phenoxy]pyridine;2-methoxy-3-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)-3-pyridinyl]pyridine has a molecular weight of 1962.16 g/mol, XLogP of 27.37, 29 rotatable bonds, 0 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyclopropylphenoxy)-3-(4-methoxy-3-pyridinyl)pyridine;ethyl 4-[[3-(4-methoxy-3-pyridinyl)-2-pyridinyl]oxy]benzoate;2-(4-ethylphenoxy)-3-(4-methoxy-3-pyridinyl)pyridine;3-(4-methoxy-3-pyridinyl)-2-(4-methylphenoxy)pyridine;3-(4-methoxy-3-pyridinyl)-2-[4-(trifluoromethoxy)phenoxy]pyridine;2-methoxy-3-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)-3-pyridinyl]pyridine is sourced from PubChem (CID 158565670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).