4-N-(4-ethoxyphenyl)-2-N,2-N-diethylpyridine-2,4-dicarboxamide

C19H23N3O3 — CID 109088955

IUPAC4-N-(4-ethoxyphenyl)-2-N,2-N-diethylpyridine-2,4-dicarboxamide
SMILESCCOc1ccc(NC(=O)c2ccnc(C(=O)N(CC)CC)c2)cc1
InChIInChI=1S/C19H23N3O3/c1-4-22(5-2)19(24)17-13-14(11-12-20-17)18(23)21-15-7-9-16(10-8-15)25-6-3/h7-13H,4-6H2,1-3H3,(H,21,23)
InChIKeyDOJLFMOVMTUBFG-UHFFFAOYSA-N
MW341.41 g/mol
LogP3.21
Rot. Bonds7

About 4-N-(4-ethoxyphenyl)-2-N,2-N-diethylpyridine-2,4-dicarboxamide

4-N-(4-ethoxyphenyl)-2-N,2-N-diethylpyridine-2,4-dicarboxamide (PubChem CID 109088955) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is 4-N-(4-ethoxyphenyl)-2-N,2-N-diethylpyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name4-N-(4-ethoxyphenyl)-2-N,2-N-diethylpyridine-2,4-dicarboxamide
PubChem CID109088955
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC Name4-N-(4-ethoxyphenyl)-2-N,2-N-diethylpyridine-2,4-dicarboxamide
SMILESCCOc1ccc(NC(=O)c2ccnc(C(=O)N(CC)CC)c2)cc1
InChIInChI=1S/C19H23N3O3/c1-4-22(5-2)19(24)17-13-14(11-12-20-17)18(23)21-15-7-9-16(10-8-15)25-6-3/h7-13H,4-6H2,1-3H3,(H,21,23)
InChIKeyDOJLFMOVMTUBFG-UHFFFAOYSA-N
XLogP3.21
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-N-butyl-4-N-(4-ethoxyphenyl)-2-N-methylpyridine-2,4-dicarboxamide
CID 109090083
4-N-(4-methoxyphenyl)-2-N,2-N-dipropylpyridine-2,4-dicarboxamide
CID 109090576
2-N-[3-(dimethylamino)propyl]-4-N-(4-ethoxyphenyl)pyridine-2,4-dicarboxamide
CID 109084095
1-N-(4-ethoxyphenyl)-4-N,4-N-diethylbenzene-1,4-dicarboxamide
CID 109048413
4-N-(3-acetamidophenyl)-2-N,2-N-diethylpyridine-2,4-dicarboxamide
CID 109088967
2-N-(4-ethoxyphenyl)-4-N-propan-2-ylpyridine-2,4-dicarboxamide
CID 109078141
4-N,4-N-diethyl-2-N-(4-phenoxyphenyl)pyridine-2,4-dicarboxamide
CID 109088859
2-N,2-N-diethyl-4-N-[4-(4-methylpiperazin-1-yl)phenyl]pyridine-2,4-dicarboxamide
CID 109088980
4-N-[4-(diethylamino)phenyl]-2-N,2-N-dipropylpyridine-2,4-dicarboxamide
CID 109090596
2-(aminomethyl)-N-(4-ethoxyphenyl)pyridine-4-carboxamide
CID 114325480
2-N-(2-chlorophenyl)-4-N-(4-ethoxyphenyl)pyridine-2,4-dicarboxamide
CID 109092798
2-(dipropylamino)-N-(4-ethoxyphenyl)pyridine-4-carboxamide
CID 109175918

Frequently Asked Questions

What is the IUPAC name of 4-N-(4-ethoxyphenyl)-2-N,2-N-diethylpyridine-2,4-dicarboxamide?
The IUPAC name of 4-N-(4-ethoxyphenyl)-2-N,2-N-diethylpyridine-2,4-dicarboxamide (CID 109088955) is 4-N-(4-ethoxyphenyl)-2-N,2-N-diethylpyridine-2,4-dicarboxamide.
What is the SMILES notation for 4-N-(4-ethoxyphenyl)-2-N,2-N-diethylpyridine-2,4-dicarboxamide?
The canonical SMILES for 4-N-(4-ethoxyphenyl)-2-N,2-N-diethylpyridine-2,4-dicarboxamide is CCOc1ccc(NC(=O)c2ccnc(C(=O)N(CC)CC)c2)cc1.
What is the InChIKey of 4-N-(4-ethoxyphenyl)-2-N,2-N-diethylpyridine-2,4-dicarboxamide?
The InChIKey is DOJLFMOVMTUBFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-4-22(5-2)19(24)17-13-14(11-12-20-17)18(23)21-15-7-9-16(10-8-15)25-6-3/h7-13H,4-6H2,1-3H3,(H,21,23).
What are the key properties of 4-N-(4-ethoxyphenyl)-2-N,2-N-diethylpyridine-2,4-dicarboxamide?
4-N-(4-ethoxyphenyl)-2-N,2-N-diethylpyridine-2,4-dicarboxamide has a molecular weight of 341.41 g/mol, XLogP of 3.21, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(4-ethoxyphenyl)-2-N,2-N-diethylpyridine-2,4-dicarboxamide is sourced from PubChem (CID 109088955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).