N-[(5,6-dimethoxy-2-pyridinyl)methyl]-2-(2-methylphenyl)-5-(5-methyl-3-pyridinyl)pyridine-3-carboxamide;N-[(1,4-dimethyl-2,3-dihydroquinoxalin-6-yl)methyl]-5-(3-hydroxy-5-methylphenyl)-2-(1-methylpyrazol-4-yl)pyridine-3-carboxamide;ethane

C59H68N10O5 — CID 143760598

IUPACN-[(5,6-dimethoxy-2-pyridinyl)methyl]-2-(2-methylphenyl)-5-(5-methyl-3-pyridinyl)pyridine-3-carboxamide;N-[(1,4-dimethyl-2,3-dihydroquinoxalin-6-yl)methyl]-5-(3-hydroxy-5-methylphenyl)-2-(1-methylpyrazol-4-yl)pyridine-3-carboxamide;ethane
SMILESCC.CC.COc1ccc(CNC(=O)c2cc(-c3cncc(C)c3)cnc2-c2ccccc2C)nc1OC.Cc1cc(O)cc(-c2cnc(-c3cnn(C)c3)c(C(=O)NCc3ccc4c(c3)N(C)CCN4C)c2)c1
InChIInChI=1S/C28H30N6O2.C27H26N4O3.2C2H6/c1-18-9-20(12-23(35)10-18)21-13-24(27(29-15-21)22-16-31-34(4)17-22)28(36)30-14-19-5-6-25-26(11-19)33(3)8-7-32(25)2;1-17-11-19(14-28-13-17)20-12-23(25(29-15-20)22-8-6-5-7-18(22)2)26(32)30-16-21-9-10-24(33-3)27(31-21)34-4;2*1-2/h5-6,9-13,15-17,35H,7-8,14H2,1-4H3,(H,30,36);5-15H,16H2,1-4H3,(H,30,32);2*1-2H3
InChIKeyXEFPOJDJAZGWQD-UHFFFAOYSA-N
MW997.26 g/mol
LogP10.80
Rot. Bonds12

About N-[(5,6-dimethoxy-2-pyridinyl)methyl]-2-(2-methylphenyl)-5-(5-methyl-3-pyridinyl)pyridine-3-carboxamide;N-[(1,4-dimethyl-2,3-dihydroquinoxalin-6-yl)methyl]-5-(3-hydroxy-5-methylphenyl)-2-(1-methylpyrazol-4-yl)pyridine-3-carboxamide;ethane

N-[(5,6-dimethoxy-2-pyridinyl)methyl]-2-(2-methylphenyl)-5-(5-methyl-3-pyridinyl)pyridine-3-carboxamide;N-[(1,4-dimethyl-2,3-dihydroquinoxalin-6-yl)methyl]-5-(3-hydroxy-5-methylphenyl)-2-(1-methylpyrazol-4-yl)pyridine-3-carboxamide;ethane (PubChem CID 143760598) has the molecular formula C59H68N10O5 and a molecular weight of 997.26 g/mol. Its IUPAC name is N-[(5,6-dimethoxy-2-pyridinyl)methyl]-2-(2-methylphenyl)-5-(5-methyl-3-pyridinyl)pyridine-3-carboxamide;N-[(1,4-dimethyl-2,3-dihydroquinoxalin-6-yl)methyl]-5-(3-hydroxy-5-methylphenyl)-2-(1-methylpyrazol-4-yl)pyridine-3-carboxamide;ethane.

Molecular Properties

Compound NameN-[(5,6-dimethoxy-2-pyridinyl)methyl]-2-(2-methylphenyl)-5-(5-methyl-3-pyridinyl)pyridine-3-carboxamide;N-[(1,4-dimethyl-2,3-dihydroquinoxalin-6-yl)methyl]-5-(3-hydroxy-5-methylphenyl)-2-(1-methylpyrazol-4-yl)pyridine-3-carboxamide;ethane
PubChem CID143760598
Molecular FormulaC59H68N10O5
Molecular Weight997.26 g/mol
Exact Mass996.54
IUPAC NameN-[(5,6-dimethoxy-2-pyridinyl)methyl]-2-(2-methylphenyl)-5-(5-methyl-3-pyridinyl)pyridine-3-carboxamide;N-[(1,4-dimethyl-2,3-dihydroquinoxalin-6-yl)methyl]-5-(3-hydroxy-5-methylphenyl)-2-(1-methylpyrazol-4-yl)pyridine-3-carboxamide;ethane
SMILESCC.CC.COc1ccc(CNC(=O)c2cc(-c3cncc(C)c3)cnc2-c2ccccc2C)nc1OC.Cc1cc(O)cc(-c2cnc(-c3cnn(C)c3)c(C(=O)NCc3ccc4c(c3)N(C)CCN4C)c2)c1
InChIInChI=1S/C28H30N6O2.C27H26N4O3.2C2H6/c1-18-9-20(12-23(35)10-18)21-13-24(27(29-15-21)22-16-31-34(4)17-22)28(36)30-14-19-5-6-25-26(11-19)33(3)8-7-32(25)2;1-17-11-19(14-28-13-17)20-12-23(25(29-15-20)22-8-6-5-7-18(22)2)26(32)30-16-21-9-10-24(33-3)27(31-21)34-4;2*1-2/h5-6,9-13,15-17,35H,7-8,14H2,1-4H3,(H,30,36);5-15H,16H2,1-4H3,(H,30,32);2*1-2H3
InChIKeyXEFPOJDJAZGWQD-UHFFFAOYSA-N
XLogP10.80
TPSA172.75 Ų
H-Bond Donors3
H-Bond Acceptors13
Rotatable Bonds12
Heavy Atoms74
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 500997.26
LogP ≤ 510.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1013

Analyze N-[(5,6-dimethoxy-2-pyridinyl)methyl]-2-(2-methylphenyl)-5-(5-methyl-3-pyridinyl)pyridine-3-carboxamide;N-[(1,4-dimethyl-2,3-dihydroquinoxalin-6-yl)methyl]-5-(3-hydroxy-5-methylphenyl)-2-(1-methylpyrazol-4-yl)pyridine-3-carboxamide;ethane with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[(5,6-dimethoxy-2-pyridinyl)methyl]-2-(2-methylphenyl)-5-(5-methyl-3-pyridinyl)pyridine-3-carboxamide;N-[(1,4-dimethyl-2,3-dihydroquinoxalin-6-yl)methyl]-5-(3-hydroxy-5-methylphenyl)-2-(1-methylpyrazol-4-yl)pyridine-3-carboxamide;ethane?
The IUPAC name of N-[(5,6-dimethoxy-2-pyridinyl)methyl]-2-(2-methylphenyl)-5-(5-methyl-3-pyridinyl)pyridine-3-carboxamide;N-[(1,4-dimethyl-2,3-dihydroquinoxalin-6-yl)methyl]-5-(3-hydroxy-5-methylphenyl)-2-(1-methylpyrazol-4-yl)pyridine-3-carboxamide;ethane (CID 143760598) is N-[(5,6-dimethoxy-2-pyridinyl)methyl]-2-(2-methylphenyl)-5-(5-methyl-3-pyridinyl)pyridine-3-carboxamide;N-[(1,4-dimethyl-2,3-dihydroquinoxalin-6-yl)methyl]-5-(3-hydroxy-5-methylphenyl)-2-(1-methylpyrazol-4-yl)pyridine-3-carboxamide;ethane.
What is the SMILES notation for N-[(5,6-dimethoxy-2-pyridinyl)methyl]-2-(2-methylphenyl)-5-(5-methyl-3-pyridinyl)pyridine-3-carboxamide;N-[(1,4-dimethyl-2,3-dihydroquinoxalin-6-yl)methyl]-5-(3-hydroxy-5-methylphenyl)-2-(1-methylpyrazol-4-yl)pyridine-3-carboxamide;ethane?
The canonical SMILES for N-[(5,6-dimethoxy-2-pyridinyl)methyl]-2-(2-methylphenyl)-5-(5-methyl-3-pyridinyl)pyridine-3-carboxamide;N-[(1,4-dimethyl-2,3-dihydroquinoxalin-6-yl)methyl]-5-(3-hydroxy-5-methylphenyl)-2-(1-methylpyrazol-4-yl)pyridine-3-carboxamide;ethane is CC.CC.COc1ccc(CNC(=O)c2cc(-c3cncc(C)c3)cnc2-c2ccccc2C)nc1OC.Cc1cc(O)cc(-c2cnc(-c3cnn(C)c3)c(C(=O)NCc3ccc4c(c3)N(C)CCN4C)c2)c1.
What is the InChIKey of N-[(5,6-dimethoxy-2-pyridinyl)methyl]-2-(2-methylphenyl)-5-(5-methyl-3-pyridinyl)pyridine-3-carboxamide;N-[(1,4-dimethyl-2,3-dihydroquinoxalin-6-yl)methyl]-5-(3-hydroxy-5-methylphenyl)-2-(1-methylpyrazol-4-yl)pyridine-3-carboxamide;ethane?
The InChIKey is XEFPOJDJAZGWQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H30N6O2.C27H26N4O3.2C2H6/c1-18-9-20(12-23(35)10-18)21-13-24(27(29-15-21)22-16-31-34(4)17-22)28(36)30-14-19-5-6-25-26(11-19)33(3)8-7-32(25)2;1-17-11-19(14-28-13-17)20-12-23(25(29-15-20)22-8-6-5-7-18(22)2)26(32)30-16-21-9-10-24(33-3)27(31-21)34-4;2*1-2/h5-6,9-13,15-17,35H,7-8,14H2,1-4H3,(H,30,36);5-15H,16H2,1-4H3,(H,30,32);2*1-2H3.
What are the key properties of N-[(5,6-dimethoxy-2-pyridinyl)methyl]-2-(2-methylphenyl)-5-(5-methyl-3-pyridinyl)pyridine-3-carboxamide;N-[(1,4-dimethyl-2,3-dihydroquinoxalin-6-yl)methyl]-5-(3-hydroxy-5-methylphenyl)-2-(1-methylpyrazol-4-yl)pyridine-3-carboxamide;ethane?
N-[(5,6-dimethoxy-2-pyridinyl)methyl]-2-(2-methylphenyl)-5-(5-methyl-3-pyridinyl)pyridine-3-carboxamide;N-[(1,4-dimethyl-2,3-dihydroquinoxalin-6-yl)methyl]-5-(3-hydroxy-5-methylphenyl)-2-(1-methylpyrazol-4-yl)pyridine-3-carboxamide;ethane has a molecular weight of 997.26 g/mol, XLogP of 10.80, 12 rotatable bonds, 3 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5,6-dimethoxy-2-pyridinyl)methyl]-2-(2-methylphenyl)-5-(5-methyl-3-pyridinyl)pyridine-3-carboxamide;N-[(1,4-dimethyl-2,3-dihydroquinoxalin-6-yl)methyl]-5-(3-hydroxy-5-methylphenyl)-2-(1-methylpyrazol-4-yl)pyridine-3-carboxamide;ethane is sourced from PubChem (CID 143760598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).