6-N-[4-(dimethylamino)phenyl]-2-N-(furan-2-ylmethyl)pyridine-2,6-dicarboxamide

C20H20N4O3 — CID 109097185

IUPAC6-N-[4-(dimethylamino)phenyl]-2-N-(furan-2-ylmethyl)pyridine-2,6-dicarboxamide
SMILESCN(C)c1ccc(NC(=O)c2cccc(C(=O)NCc3ccco3)n2)cc1
InChIInChI=1S/C20H20N4O3/c1-24(2)15-10-8-14(9-11-15)22-20(26)18-7-3-6-17(23-18)19(25)21-13-16-5-4-12-27-16/h3-12H,13H2,1-2H3,(H,21,25)(H,22,26)
InChIKeyQWDNVNLMVAORBB-UHFFFAOYSA-N
MW364.41 g/mol
LogP2.92
Rot. Bonds6

About 6-N-[4-(dimethylamino)phenyl]-2-N-(furan-2-ylmethyl)pyridine-2,6-dicarboxamide

6-N-[4-(dimethylamino)phenyl]-2-N-(furan-2-ylmethyl)pyridine-2,6-dicarboxamide (PubChem CID 109097185) has the molecular formula C20H20N4O3 and a molecular weight of 364.41 g/mol. Its IUPAC name is 6-N-[4-(dimethylamino)phenyl]-2-N-(furan-2-ylmethyl)pyridine-2,6-dicarboxamide.

Molecular Properties

Compound Name6-N-[4-(dimethylamino)phenyl]-2-N-(furan-2-ylmethyl)pyridine-2,6-dicarboxamide
PubChem CID109097185
Molecular FormulaC20H20N4O3
Molecular Weight364.41 g/mol
Exact Mass364.15
IUPAC Name6-N-[4-(dimethylamino)phenyl]-2-N-(furan-2-ylmethyl)pyridine-2,6-dicarboxamide
SMILESCN(C)c1ccc(NC(=O)c2cccc(C(=O)NCc3ccco3)n2)cc1
InChIInChI=1S/C20H20N4O3/c1-24(2)15-10-8-14(9-11-15)22-20(26)18-7-3-6-17(23-18)19(25)21-13-16-5-4-12-27-16/h3-12H,13H2,1-2H3,(H,21,25)(H,22,26)
InChIKeyQWDNVNLMVAORBB-UHFFFAOYSA-N
XLogP2.92
TPSA87.47 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.41
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

2-N-(furan-2-ylmethyl)-6-N-(4-propan-2-yloxyphenyl)pyridine-2,6-dicarboxamide
CID 109097171
6-N-(3-acetylphenyl)-2-N-(furan-2-ylmethyl)pyridine-2,6-dicarboxamide
CID 109097178
N'-[4-(dimethylamino)phenyl]-N-(furan-2-ylmethyl)oxamide
CID 3148860
6-[4-(dimethylamino)anilino]-N-(furan-2-ylmethyl)-2-methylpyrimidine-4-carboxamide
CID 109368191
2-N-[2-(dimethylamino)ethyl]-6-N-[4-(dimethylamino)phenyl]pyridine-2,6-dicarboxamide
CID 109096394
6-N-benzyl-2-N-(furan-2-ylmethyl)-6-N-methylpyridine-2,6-dicarboxamide
CID 109097082
2-N-[4-(dimethylamino)phenyl]-6-N,6-N-dipropylpyridine-2,6-dicarboxamide
CID 109099834
N-[4-(dimethylamino)phenyl]-2-(furan-2-ylmethylamino)acetamide
CID 54773447
4-N-[4-(diethylamino)phenyl]-1-N-(furan-2-ylmethyl)benzene-1,4-dicarboxamide
CID 109046633
6-N-(2,5-dichlorophenyl)-2-N-(furan-2-ylmethyl)pyridine-2,6-dicarboxamide
CID 109097197
6-N-ethyl-2-N-(furan-2-ylmethyl)-6-N-(3-methylphenyl)pyridine-2,6-dicarboxamide
CID 109097206
N-[4-(diethylamino)phenyl]-2-(furan-2-ylmethylamino)pyrimidine-4-carboxamide
CID 109303374

Frequently Asked Questions

What is the IUPAC name of 6-N-[4-(dimethylamino)phenyl]-2-N-(furan-2-ylmethyl)pyridine-2,6-dicarboxamide?
The IUPAC name of 6-N-[4-(dimethylamino)phenyl]-2-N-(furan-2-ylmethyl)pyridine-2,6-dicarboxamide (CID 109097185) is 6-N-[4-(dimethylamino)phenyl]-2-N-(furan-2-ylmethyl)pyridine-2,6-dicarboxamide.
What is the SMILES notation for 6-N-[4-(dimethylamino)phenyl]-2-N-(furan-2-ylmethyl)pyridine-2,6-dicarboxamide?
The canonical SMILES for 6-N-[4-(dimethylamino)phenyl]-2-N-(furan-2-ylmethyl)pyridine-2,6-dicarboxamide is CN(C)c1ccc(NC(=O)c2cccc(C(=O)NCc3ccco3)n2)cc1.
What is the InChIKey of 6-N-[4-(dimethylamino)phenyl]-2-N-(furan-2-ylmethyl)pyridine-2,6-dicarboxamide?
The InChIKey is QWDNVNLMVAORBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O3/c1-24(2)15-10-8-14(9-11-15)22-20(26)18-7-3-6-17(23-18)19(25)21-13-16-5-4-12-27-16/h3-12H,13H2,1-2H3,(H,21,25)(H,22,26).
What are the key properties of 6-N-[4-(dimethylamino)phenyl]-2-N-(furan-2-ylmethyl)pyridine-2,6-dicarboxamide?
6-N-[4-(dimethylamino)phenyl]-2-N-(furan-2-ylmethyl)pyridine-2,6-dicarboxamide has a molecular weight of 364.41 g/mol, XLogP of 2.92, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-[4-(dimethylamino)phenyl]-2-N-(furan-2-ylmethyl)pyridine-2,6-dicarboxamide is sourced from PubChem (CID 109097185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).