2-N-[4-(dimethylamino)phenyl]-4-N-(2-methoxyphenyl)pyridine-2,4-dicarboxamide

C22H22N4O3 — CID 109092996

IUPAC2-N-[4-(dimethylamino)phenyl]-4-N-(2-methoxyphenyl)pyridine-2,4-dicarboxamide
SMILESCOc1ccccc1NC(=O)c1ccnc(C(=O)Nc2ccc(N(C)C)cc2)c1
InChIInChI=1S/C22H22N4O3/c1-26(2)17-10-8-16(9-11-17)24-22(28)19-14-15(12-13-23-19)21(27)25-18-6-4-5-7-20(18)29-3/h4-14H,1-3H3,(H,24,28)(H,25,27)
InChIKeyFGQMNNZCJKOQIQ-UHFFFAOYSA-N
MW390.44 g/mol
LogP3.66
Rot. Bonds6

About 2-N-[4-(dimethylamino)phenyl]-4-N-(2-methoxyphenyl)pyridine-2,4-dicarboxamide

2-N-[4-(dimethylamino)phenyl]-4-N-(2-methoxyphenyl)pyridine-2,4-dicarboxamide (PubChem CID 109092996) has the molecular formula C22H22N4O3 and a molecular weight of 390.44 g/mol. Its IUPAC name is 2-N-[4-(dimethylamino)phenyl]-4-N-(2-methoxyphenyl)pyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name2-N-[4-(dimethylamino)phenyl]-4-N-(2-methoxyphenyl)pyridine-2,4-dicarboxamide
PubChem CID109092996
Molecular FormulaC22H22N4O3
Molecular Weight390.44 g/mol
Exact Mass390.17
IUPAC Name2-N-[4-(dimethylamino)phenyl]-4-N-(2-methoxyphenyl)pyridine-2,4-dicarboxamide
SMILESCOc1ccccc1NC(=O)c1ccnc(C(=O)Nc2ccc(N(C)C)cc2)c1
InChIInChI=1S/C22H22N4O3/c1-26(2)17-10-8-16(9-11-17)24-22(28)19-14-15(12-13-23-19)21(27)25-18-6-4-5-7-20(18)29-3/h4-14H,1-3H3,(H,24,28)(H,25,27)
InChIKeyFGQMNNZCJKOQIQ-UHFFFAOYSA-N
XLogP3.66
TPSA83.56 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.44
LogP ≤ 53.66
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

4-N-[4-(dimethylamino)phenyl]-2-N-(2-ethylphenyl)pyridine-2,4-dicarboxamide
CID 109092240
2-N-(2-methoxyphenyl)-4-N-methyl-4-N-phenylpyridine-2,4-dicarboxamide
CID 109091430
4-N-(4-ethoxyphenyl)-2-N-(2-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109093012
2-N-(3-chloro-4-fluorophenyl)-4-N-(2-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109092969
2-N-(2-fluorophenyl)-4-N-(2-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109092647
2-N-(4-chlorophenyl)-4-N-[4-(dimethylamino)phenyl]pyridine-2,4-dicarboxamide
CID 109092885
4-[(2-methoxyphenyl)carbamoyl]pyridine-2-carboxylic acid
CID 115730044
2-N-(2,5-dimethoxyphenyl)-4-N-phenylpyridine-2,4-dicarboxamide
CID 109090853
2-N-(2,3-dimethylphenyl)-4-N-(2-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109092159
6-[4-(dimethylamino)anilino]-N-(2-methoxyphenyl)pyrimidine-4-carboxamide
CID 109358760
2-N-(2-ethoxyphenyl)-4-N-phenylpyridine-2,4-dicarboxamide
CID 109090848
N-(2-methoxyphenyl)-4-(N-methylanilino)pyridine-2-carboxamide
CID 109219451

Frequently Asked Questions

What is the IUPAC name of 2-N-[4-(dimethylamino)phenyl]-4-N-(2-methoxyphenyl)pyridine-2,4-dicarboxamide?
The IUPAC name of 2-N-[4-(dimethylamino)phenyl]-4-N-(2-methoxyphenyl)pyridine-2,4-dicarboxamide (CID 109092996) is 2-N-[4-(dimethylamino)phenyl]-4-N-(2-methoxyphenyl)pyridine-2,4-dicarboxamide.
What is the SMILES notation for 2-N-[4-(dimethylamino)phenyl]-4-N-(2-methoxyphenyl)pyridine-2,4-dicarboxamide?
The canonical SMILES for 2-N-[4-(dimethylamino)phenyl]-4-N-(2-methoxyphenyl)pyridine-2,4-dicarboxamide is COc1ccccc1NC(=O)c1ccnc(C(=O)Nc2ccc(N(C)C)cc2)c1.
What is the InChIKey of 2-N-[4-(dimethylamino)phenyl]-4-N-(2-methoxyphenyl)pyridine-2,4-dicarboxamide?
The InChIKey is FGQMNNZCJKOQIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N4O3/c1-26(2)17-10-8-16(9-11-17)24-22(28)19-14-15(12-13-23-19)21(27)25-18-6-4-5-7-20(18)29-3/h4-14H,1-3H3,(H,24,28)(H,25,27).
What are the key properties of 2-N-[4-(dimethylamino)phenyl]-4-N-(2-methoxyphenyl)pyridine-2,4-dicarboxamide?
2-N-[4-(dimethylamino)phenyl]-4-N-(2-methoxyphenyl)pyridine-2,4-dicarboxamide has a molecular weight of 390.44 g/mol, XLogP of 3.66, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-[4-(dimethylamino)phenyl]-4-N-(2-methoxyphenyl)pyridine-2,4-dicarboxamide is sourced from PubChem (CID 109092996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).