bis(4-[3-fluoro-4-[(4-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide);4-[3-fluoro-4-[[4-(1,1,1,2-tetrafluoropropan-2-yl)phenyl]carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;bis(N-methyl-4-[4-[(4-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide);N-methyl-4-[4-[[4-(1,1,1,2-tetrafluoropropan-2-yl)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide

C130H117F11N24O18 — CID 158942055

IUPACbis(4-[3-fluoro-4-[(4-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide);4-[3-fluoro-4-[[4-(1,1,1,2-tetrafluoropropan-2-yl)phenyl]carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;bis(N-methyl-4-[4-[(4-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide);N-methyl-4-[4-[[4-(1,1,1,2-tetrafluoropropan-2-yl)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide
SMILESCNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(C(C)(F)C(F)(F)F)cc3)c(F)c2)ccn1.CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(C(C)(F)C(F)(F)F)cc3)cc2)ccn1.CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(C)cc3)c(F)c2)ccn1.CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(C)cc3)c(F)c2)ccn1.CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(C)cc3)cc2)ccn1.CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(C)cc3)cc2)ccn1
InChIInChI=1S/C23H19F5N4O3.C23H20F4N4O3.2C21H19FN4O3.2C21H20N4O3/c1-22(25,23(26,27)28)13-3-5-14(6-4-13)31-21(34)32-18-8-7-15(11-17(18)24)35-16-9-10-30-19(12-16)20(33)29-2;1-22(24,23(25,26)27)14-3-5-15(6-4-14)30-21(33)31-16-7-9-17(10-8-16)34-18-11-12-29-19(13-18)20(32)28-2;2*1-13-3-5-14(6-4-13)25-21(28)26-18-8-7-15(11-17(18)22)29-16-9-10-24-19(12-16)20(27)23-2;2*1-14-3-5-15(6-4-14)24-21(27)25-16-7-9-17(10-8-16)28-18-11-12-23-19(13-18)20(26)22-2/h3-12H,1-2H3,(H,29,33)(H2,31,32,34);3-13H,1-2H3,(H,28,32)(H2,30,31,33);2*3-12H,1-2H3,(H,23,27)(H2,25,26,28);2*3-13H,1-2H3,(H,22,26)(H2,24,25,27)
InChIKeyJKJIDRBMESVBEO-UHFFFAOYSA-N
MW2512.49 g/mol
LogP28.41
Rot. Bonds32

About bis(4-[3-fluoro-4-[(4-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide);4-[3-fluoro-4-[[4-(1,1,1,2-tetrafluoropropan-2-yl)phenyl]carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;bis(N-methyl-4-[4-[(4-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide);N-methyl-4-[4-[[4-(1,1,1,2-tetrafluoropropan-2-yl)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide

bis(4-[3-fluoro-4-[(4-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide);4-[3-fluoro-4-[[4-(1,1,1,2-tetrafluoropropan-2-yl)phenyl]carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;bis(N-methyl-4-[4-[(4-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide);N-methyl-4-[4-[[4-(1,1,1,2-tetrafluoropropan-2-yl)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide (PubChem CID 158942055) has the molecular formula C130H117F11N24O18 and a molecular weight of 2512.49 g/mol. Its IUPAC name is bis(4-[3-fluoro-4-[(4-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide);4-[3-fluoro-4-[[4-(1,1,1,2-tetrafluoropropan-2-yl)phenyl]carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;bis(N-methyl-4-[4-[(4-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide);N-methyl-4-[4-[[4-(1,1,1,2-tetrafluoropropan-2-yl)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide.

Molecular Properties

Compound Namebis(4-[3-fluoro-4-[(4-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide);4-[3-fluoro-4-[[4-(1,1,1,2-tetrafluoropropan-2-yl)phenyl]carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;bis(N-methyl-4-[4-[(4-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide);N-methyl-4-[4-[[4-(1,1,1,2-tetrafluoropropan-2-yl)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide
PubChem CID158942055
Molecular FormulaC130H117F11N24O18
Molecular Weight2512.49 g/mol
Exact Mass2510.88
IUPAC Namebis(4-[3-fluoro-4-[(4-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide);4-[3-fluoro-4-[[4-(1,1,1,2-tetrafluoropropan-2-yl)phenyl]carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;bis(N-methyl-4-[4-[(4-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide);N-methyl-4-[4-[[4-(1,1,1,2-tetrafluoropropan-2-yl)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide
SMILESCNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(C(C)(F)C(F)(F)F)cc3)c(F)c2)ccn1.CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(C(C)(F)C(F)(F)F)cc3)cc2)ccn1.CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(C)cc3)c(F)c2)ccn1.CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(C)cc3)c(F)c2)ccn1.CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(C)cc3)cc2)ccn1.CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(C)cc3)cc2)ccn1
InChIInChI=1S/C23H19F5N4O3.C23H20F4N4O3.2C21H19FN4O3.2C21H20N4O3/c1-22(25,23(26,27)28)13-3-5-14(6-4-13)31-21(34)32-18-8-7-15(11-17(18)24)35-16-9-10-30-19(12-16)20(33)29-2;1-22(24,23(25,26)27)14-3-5-15(6-4-14)30-21(33)31-16-7-9-17(10-8-16)34-18-11-12-29-19(13-18)20(32)28-2;2*1-13-3-5-14(6-4-13)25-21(28)26-18-8-7-15(11-17(18)22)29-16-9-10-24-19(12-16)20(27)23-2;2*1-14-3-5-15(6-4-14)24-21(27)25-16-7-9-17(10-8-16)28-18-11-12-23-19(13-18)20(26)22-2/h3-12H,1-2H3,(H,29,33)(H2,31,32,34);3-13H,1-2H3,(H,28,32)(H2,30,31,33);2*3-12H,1-2H3,(H,23,27)(H2,25,26,28);2*3-13H,1-2H3,(H,22,26)(H2,24,25,27)
InChIKeyJKJIDRBMESVBEO-UHFFFAOYSA-N
XLogP28.41
TPSA554.10 Ų
H-Bond Donors18
H-Bond Acceptors24
Rotatable Bonds32
Heavy Atoms183
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002512.49
LogP ≤ 528.41
H-Bond Donors ≤ 518
H-Bond Acceptors ≤ 1024

Analyze bis(4-[3-fluoro-4-[(4-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide);4-[3-fluoro-4-[[4-(1,1,1,2-tetrafluoropropan-2-yl)phenyl]carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;bis(N-methyl-4-[4-[(4-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide);N-methyl-4-[4-[[4-(1,1,1,2-tetrafluoropropan-2-yl)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of bis(4-[3-fluoro-4-[(4-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide);4-[3-fluoro-4-[[4-(1,1,1,2-tetrafluoropropan-2-yl)phenyl]carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;bis(N-methyl-4-[4-[(4-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide);N-methyl-4-[4-[[4-(1,1,1,2-tetrafluoropropan-2-yl)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide?
The IUPAC name of bis(4-[3-fluoro-4-[(4-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide);4-[3-fluoro-4-[[4-(1,1,1,2-tetrafluoropropan-2-yl)phenyl]carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;bis(N-methyl-4-[4-[(4-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide);N-methyl-4-[4-[[4-(1,1,1,2-tetrafluoropropan-2-yl)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide (CID 158942055) is bis(4-[3-fluoro-4-[(4-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide);4-[3-fluoro-4-[[4-(1,1,1,2-tetrafluoropropan-2-yl)phenyl]carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;bis(N-methyl-4-[4-[(4-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide);N-methyl-4-[4-[[4-(1,1,1,2-tetrafluoropropan-2-yl)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide.
What is the SMILES notation for bis(4-[3-fluoro-4-[(4-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide);4-[3-fluoro-4-[[4-(1,1,1,2-tetrafluoropropan-2-yl)phenyl]carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;bis(N-methyl-4-[4-[(4-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide);N-methyl-4-[4-[[4-(1,1,1,2-tetrafluoropropan-2-yl)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide?
The canonical SMILES for bis(4-[3-fluoro-4-[(4-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide);4-[3-fluoro-4-[[4-(1,1,1,2-tetrafluoropropan-2-yl)phenyl]carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;bis(N-methyl-4-[4-[(4-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide);N-methyl-4-[4-[[4-(1,1,1,2-tetrafluoropropan-2-yl)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide is CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(C(C)(F)C(F)(F)F)cc3)c(F)c2)ccn1.CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(C(C)(F)C(F)(F)F)cc3)cc2)ccn1.CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(C)cc3)c(F)c2)ccn1.CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(C)cc3)c(F)c2)ccn1.CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(C)cc3)cc2)ccn1.CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(C)cc3)cc2)ccn1.
What is the InChIKey of bis(4-[3-fluoro-4-[(4-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide);4-[3-fluoro-4-[[4-(1,1,1,2-tetrafluoropropan-2-yl)phenyl]carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;bis(N-methyl-4-[4-[(4-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide);N-methyl-4-[4-[[4-(1,1,1,2-tetrafluoropropan-2-yl)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide?
The InChIKey is JKJIDRBMESVBEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19F5N4O3.C23H20F4N4O3.2C21H19FN4O3.2C21H20N4O3/c1-22(25,23(26,27)28)13-3-5-14(6-4-13)31-21(34)32-18-8-7-15(11-17(18)24)35-16-9-10-30-19(12-16)20(33)29-2;1-22(24,23(25,26)27)14-3-5-15(6-4-14)30-21(33)31-16-7-9-17(10-8-16)34-18-11-12-29-19(13-18)20(32)28-2;2*1-13-3-5-14(6-4-13)25-21(28)26-18-8-7-15(11-17(18)22)29-16-9-10-24-19(12-16)20(27)23-2;2*1-14-3-5-15(6-4-14)24-21(27)25-16-7-9-17(10-8-16)28-18-11-12-23-19(13-18)20(26)22-2/h3-12H,1-2H3,(H,29,33)(H2,31,32,34);3-13H,1-2H3,(H,28,32)(H2,30,31,33);2*3-12H,1-2H3,(H,23,27)(H2,25,26,28);2*3-13H,1-2H3,(H,22,26)(H2,24,25,27).
What are the key properties of bis(4-[3-fluoro-4-[(4-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide);4-[3-fluoro-4-[[4-(1,1,1,2-tetrafluoropropan-2-yl)phenyl]carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;bis(N-methyl-4-[4-[(4-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide);N-methyl-4-[4-[[4-(1,1,1,2-tetrafluoropropan-2-yl)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide?
bis(4-[3-fluoro-4-[(4-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide);4-[3-fluoro-4-[[4-(1,1,1,2-tetrafluoropropan-2-yl)phenyl]carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;bis(N-methyl-4-[4-[(4-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide);N-methyl-4-[4-[[4-(1,1,1,2-tetrafluoropropan-2-yl)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide has a molecular weight of 2512.49 g/mol, XLogP of 28.41, 32 rotatable bonds, 18 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for bis(4-[3-fluoro-4-[(4-methylphenyl)carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide);4-[3-fluoro-4-[[4-(1,1,1,2-tetrafluoropropan-2-yl)phenyl]carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;bis(N-methyl-4-[4-[(4-methylphenyl)carbamoylamino]phenoxy]pyridine-2-carboxamide);N-methyl-4-[4-[[4-(1,1,1,2-tetrafluoropropan-2-yl)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide is sourced from PubChem (CID 158942055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).