5-N-(4-ethoxyphenyl)-3-N-(furan-2-ylmethyl)pyridine-3,5-dicarboxamide

C20H19N3O4 — CID 109104924

IUPAC5-N-(4-ethoxyphenyl)-3-N-(furan-2-ylmethyl)pyridine-3,5-dicarboxamide
SMILESCCOc1ccc(NC(=O)c2cncc(C(=O)NCc3ccco3)c2)cc1
InChIInChI=1S/C20H19N3O4/c1-2-26-17-7-5-16(6-8-17)23-20(25)15-10-14(11-21-12-15)19(24)22-13-18-4-3-9-27-18/h3-12H,2,13H2,1H3,(H,22,24)(H,23,25)
InChIKeyKMLAMQUNZHHQHQ-UHFFFAOYSA-N
MW365.39 g/mol
LogP3.26
Rot. Bonds7

About 5-N-(4-ethoxyphenyl)-3-N-(furan-2-ylmethyl)pyridine-3,5-dicarboxamide

5-N-(4-ethoxyphenyl)-3-N-(furan-2-ylmethyl)pyridine-3,5-dicarboxamide (PubChem CID 109104924) has the molecular formula C20H19N3O4 and a molecular weight of 365.39 g/mol. Its IUPAC name is 5-N-(4-ethoxyphenyl)-3-N-(furan-2-ylmethyl)pyridine-3,5-dicarboxamide.

Molecular Properties

Compound Name5-N-(4-ethoxyphenyl)-3-N-(furan-2-ylmethyl)pyridine-3,5-dicarboxamide
PubChem CID109104924
Molecular FormulaC20H19N3O4
Molecular Weight365.39 g/mol
Exact Mass365.14
IUPAC Name5-N-(4-ethoxyphenyl)-3-N-(furan-2-ylmethyl)pyridine-3,5-dicarboxamide
SMILESCCOc1ccc(NC(=O)c2cncc(C(=O)NCc3ccco3)c2)cc1
InChIInChI=1S/C20H19N3O4/c1-2-26-17-7-5-16(6-8-17)23-20(25)15-10-14(11-21-12-15)19(24)22-13-18-4-3-9-27-18/h3-12H,2,13H2,1H3,(H,22,24)(H,23,25)
InChIKeyKMLAMQUNZHHQHQ-UHFFFAOYSA-N
XLogP3.26
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 ≤ 53.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 4-[[5-(furan-2-ylmethylcarbamoyl)pyridine-3-carbonyl]amino]benzoate
CID 109104940
2-N-(4-ethoxyphenyl)-4-N-(furan-2-ylmethyl)pyridine-2,4-dicarboxamide
CID 109085098
5-N-(4-fluorophenyl)-3-N-(furan-2-ylmethyl)pyridine-3,5-dicarboxamide
CID 109104908
ethyl 4-[[3-(furan-2-ylmethylcarbamoyl)benzoyl]amino]benzoate
CID 109054059
3-N-(4-acetamidophenyl)-1-N-(furan-2-ylmethyl)benzene-1,3-dicarboxamide
CID 109054046
5-(furan-2-ylmethylamino)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 109231569
5-bromo-N-(4-ethoxyphenyl)pyridine-3-carboxamide
CID 835761
4-N-(furan-2-ylmethyl)-2-N-(4-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109085096
ethyl 4-[[5-(furan-2-ylmethylamino)pyridine-3-carbonyl]amino]benzoate
CID 109231605
5-N-(2-ethyl-6-methylphenyl)-3-N-(furan-2-ylmethyl)pyridine-3,5-dicarboxamide
CID 109104899
3-N-(furan-2-ylmethyl)-5-N,5-N-dipropylpyridine-3,5-dicarboxamide
CID 109104880
5-N-(3-chlorophenyl)-3-N-(4-ethoxyphenyl)pyridine-3,5-dicarboxamide
CID 109108789

Frequently Asked Questions

What is the IUPAC name of 5-N-(4-ethoxyphenyl)-3-N-(furan-2-ylmethyl)pyridine-3,5-dicarboxamide?
The IUPAC name of 5-N-(4-ethoxyphenyl)-3-N-(furan-2-ylmethyl)pyridine-3,5-dicarboxamide (CID 109104924) is 5-N-(4-ethoxyphenyl)-3-N-(furan-2-ylmethyl)pyridine-3,5-dicarboxamide.
What is the SMILES notation for 5-N-(4-ethoxyphenyl)-3-N-(furan-2-ylmethyl)pyridine-3,5-dicarboxamide?
The canonical SMILES for 5-N-(4-ethoxyphenyl)-3-N-(furan-2-ylmethyl)pyridine-3,5-dicarboxamide is CCOc1ccc(NC(=O)c2cncc(C(=O)NCc3ccco3)c2)cc1.
What is the InChIKey of 5-N-(4-ethoxyphenyl)-3-N-(furan-2-ylmethyl)pyridine-3,5-dicarboxamide?
The InChIKey is KMLAMQUNZHHQHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O4/c1-2-26-17-7-5-16(6-8-17)23-20(25)15-10-14(11-21-12-15)19(24)22-13-18-4-3-9-27-18/h3-12H,2,13H2,1H3,(H,22,24)(H,23,25).
What are the key properties of 5-N-(4-ethoxyphenyl)-3-N-(furan-2-ylmethyl)pyridine-3,5-dicarboxamide?
5-N-(4-ethoxyphenyl)-3-N-(furan-2-ylmethyl)pyridine-3,5-dicarboxamide has a molecular weight of 365.39 g/mol, XLogP of 3.26, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-(4-ethoxyphenyl)-3-N-(furan-2-ylmethyl)pyridine-3,5-dicarboxamide is sourced from PubChem (CID 109104924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).