4-N,4-N-diethyl-2-N-(2-morpholin-4-ylphenyl)pyridine-2,4-dicarboxamide

C21H26N4O3 — CID 109088856

IUPAC4-N,4-N-diethyl-2-N-(2-morpholin-4-ylphenyl)pyridine-2,4-dicarboxamide
SMILESCCN(CC)C(=O)c1ccnc(C(=O)Nc2ccccc2N2CCOCC2)c1
InChIInChI=1S/C21H26N4O3/c1-3-24(4-2)21(27)16-9-10-22-18(15-16)20(26)23-17-7-5-6-8-19(17)25-11-13-28-14-12-25/h5-10,15H,3-4,11-14H2,1-2H3,(H,23,26)
InChIKeyTVIWXQKQCVIZJP-UHFFFAOYSA-N
MW382.46 g/mol
LogP2.65
Rot. Bonds6

About 4-N,4-N-diethyl-2-N-(2-morpholin-4-ylphenyl)pyridine-2,4-dicarboxamide

4-N,4-N-diethyl-2-N-(2-morpholin-4-ylphenyl)pyridine-2,4-dicarboxamide (PubChem CID 109088856) has the molecular formula C21H26N4O3 and a molecular weight of 382.46 g/mol. Its IUPAC name is 4-N,4-N-diethyl-2-N-(2-morpholin-4-ylphenyl)pyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name4-N,4-N-diethyl-2-N-(2-morpholin-4-ylphenyl)pyridine-2,4-dicarboxamide
PubChem CID109088856
Molecular FormulaC21H26N4O3
Molecular Weight382.46 g/mol
Exact Mass382.20
IUPAC Name4-N,4-N-diethyl-2-N-(2-morpholin-4-ylphenyl)pyridine-2,4-dicarboxamide
SMILESCCN(CC)C(=O)c1ccnc(C(=O)Nc2ccccc2N2CCOCC2)c1
InChIInChI=1S/C21H26N4O3/c1-3-24(4-2)21(27)16-9-10-22-18(15-16)20(26)23-17-7-5-6-8-19(17)25-11-13-28-14-12-25/h5-10,15H,3-4,11-14H2,1-2H3,(H,23,26)
InChIKeyTVIWXQKQCVIZJP-UHFFFAOYSA-N
XLogP2.65
TPSA74.77 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.46
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-N-cyclopropyl-4-N-(2-morpholin-4-ylphenyl)pyridine-2,4-dicarboxamide
CID 109078752
4-(4-methylpiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)pyridine-2-carboxamide
CID 109208362
4-(2-methylanilino)-N-(2-morpholin-4-ylphenyl)pyridine-2-carboxamide
CID 109219045
2-(4-ethylpiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)pyridine-4-carboxamide
CID 109168802
4-N,4-N-diethyl-2-N-(4-pyrrolidin-1-ylphenyl)pyridine-2,4-dicarboxamide
CID 109088853
2-(diethylamino)-N-(2-morpholin-4-ylphenyl)pyrimidine-5-carboxamide
CID 109262545
N',N'-diethyl-N-(2-morpholin-4-ylphenyl)oxamide
CID 108526068
6-(diethylamino)-N-(2-morpholin-4-ylphenyl)pyridazine-3-carboxamide
CID 109124354
N-(2-morpholin-4-ylphenyl)isoquinoline-3-carboxamide
CID 110862406
N',N'-diethyl-N-(2-morpholin-4-ylphenyl)propanediamide
CID 108951131
2-(2-ethylpiperidin-1-yl)-N-(2-morpholin-4-ylphenyl)pyridine-4-carboxamide
CID 109175707
1-(2-fluorophenyl)-5-methyl-N-(2-morpholin-4-ylphenyl)pyrazole-3-carboxamide
CID 110425327

Frequently Asked Questions

What is the IUPAC name of 4-N,4-N-diethyl-2-N-(2-morpholin-4-ylphenyl)pyridine-2,4-dicarboxamide?
The IUPAC name of 4-N,4-N-diethyl-2-N-(2-morpholin-4-ylphenyl)pyridine-2,4-dicarboxamide (CID 109088856) is 4-N,4-N-diethyl-2-N-(2-morpholin-4-ylphenyl)pyridine-2,4-dicarboxamide.
What is the SMILES notation for 4-N,4-N-diethyl-2-N-(2-morpholin-4-ylphenyl)pyridine-2,4-dicarboxamide?
The canonical SMILES for 4-N,4-N-diethyl-2-N-(2-morpholin-4-ylphenyl)pyridine-2,4-dicarboxamide is CCN(CC)C(=O)c1ccnc(C(=O)Nc2ccccc2N2CCOCC2)c1.
What is the InChIKey of 4-N,4-N-diethyl-2-N-(2-morpholin-4-ylphenyl)pyridine-2,4-dicarboxamide?
The InChIKey is TVIWXQKQCVIZJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N4O3/c1-3-24(4-2)21(27)16-9-10-22-18(15-16)20(26)23-17-7-5-6-8-19(17)25-11-13-28-14-12-25/h5-10,15H,3-4,11-14H2,1-2H3,(H,23,26).
What are the key properties of 4-N,4-N-diethyl-2-N-(2-morpholin-4-ylphenyl)pyridine-2,4-dicarboxamide?
4-N,4-N-diethyl-2-N-(2-morpholin-4-ylphenyl)pyridine-2,4-dicarboxamide has a molecular weight of 382.46 g/mol, XLogP of 2.65, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N,4-N-diethyl-2-N-(2-morpholin-4-ylphenyl)pyridine-2,4-dicarboxamide is sourced from PubChem (CID 109088856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).