2-N-(furan-2-ylmethyl)-4-N-[(2-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide

C20H19N3O4 — CID 109085151

IUPAC2-N-(furan-2-ylmethyl)-4-N-[(2-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide
SMILESCOc1ccccc1CNC(=O)c1ccnc(C(=O)NCc2ccco2)c1
InChIInChI=1S/C20H19N3O4/c1-26-18-7-3-2-5-15(18)12-22-19(24)14-8-9-21-17(11-14)20(25)23-13-16-6-4-10-27-16/h2-11H,12-13H2,1H3,(H,22,24)(H,23,25)
InChIKeyLSAYBRVHORBUER-UHFFFAOYSA-N
MW365.39 g/mol
LogP2.54
Rot. Bonds7

About 2-N-(furan-2-ylmethyl)-4-N-[(2-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide

2-N-(furan-2-ylmethyl)-4-N-[(2-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide (PubChem CID 109085151) has the molecular formula C20H19N3O4 and a molecular weight of 365.39 g/mol. Its IUPAC name is 2-N-(furan-2-ylmethyl)-4-N-[(2-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name2-N-(furan-2-ylmethyl)-4-N-[(2-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide
PubChem CID109085151
Molecular FormulaC20H19N3O4
Molecular Weight365.39 g/mol
Exact Mass365.14
IUPAC Name2-N-(furan-2-ylmethyl)-4-N-[(2-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide
SMILESCOc1ccccc1CNC(=O)c1ccnc(C(=O)NCc2ccco2)c1
InChIInChI=1S/C20H19N3O4/c1-26-18-7-3-2-5-15(18)12-22-19(24)14-8-9-21-17(11-14)20(25)23-13-16-6-4-10-27-16/h2-11H,12-13H2,1H3,(H,22,24)(H,23,25)
InChIKeyLSAYBRVHORBUER-UHFFFAOYSA-N
XLogP2.54
TPSA93.46 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.39
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-N-(furan-2-ylmethyl)-4-N-[(2-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide?
The IUPAC name of 2-N-(furan-2-ylmethyl)-4-N-[(2-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide (CID 109085151) is 2-N-(furan-2-ylmethyl)-4-N-[(2-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide.
What is the SMILES notation for 2-N-(furan-2-ylmethyl)-4-N-[(2-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide?
The canonical SMILES for 2-N-(furan-2-ylmethyl)-4-N-[(2-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide is COc1ccccc1CNC(=O)c1ccnc(C(=O)NCc2ccco2)c1.
What is the InChIKey of 2-N-(furan-2-ylmethyl)-4-N-[(2-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide?
The InChIKey is LSAYBRVHORBUER-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O4/c1-26-18-7-3-2-5-15(18)12-22-19(24)14-8-9-21-17(11-14)20(25)23-13-16-6-4-10-27-16/h2-11H,12-13H2,1H3,(H,22,24)(H,23,25).
What are the key properties of 2-N-(furan-2-ylmethyl)-4-N-[(2-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide?
2-N-(furan-2-ylmethyl)-4-N-[(2-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide has a molecular weight of 365.39 g/mol, XLogP of 2.54, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(furan-2-ylmethyl)-4-N-[(2-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide is sourced from PubChem (CID 109085151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).