6-[4-(dimethylamino)anilino]-N-(4-ethoxyphenyl)pyridine-3-carboxamide

C22H24N4O2 — CID 109164189

IUPAC6-[4-(dimethylamino)anilino]-N-(4-ethoxyphenyl)pyridine-3-carboxamide
SMILESCCOc1ccc(NC(=O)c2ccc(Nc3ccc(N(C)C)cc3)nc2)cc1
InChIInChI=1S/C22H24N4O2/c1-4-28-20-12-8-18(9-13-20)25-22(27)16-5-14-21(23-15-16)24-17-6-10-19(11-7-17)26(2)3/h5-15H,4H2,1-3H3,(H,23,24)(H,25,27)
InChIKeyKEDQVNGIAVSVLS-UHFFFAOYSA-N
MW376.46 g/mol
LogP4.54
Rot. Bonds7

About 6-[4-(dimethylamino)anilino]-N-(4-ethoxyphenyl)pyridine-3-carboxamide

6-[4-(dimethylamino)anilino]-N-(4-ethoxyphenyl)pyridine-3-carboxamide (PubChem CID 109164189) has the molecular formula C22H24N4O2 and a molecular weight of 376.46 g/mol. Its IUPAC name is 6-[4-(dimethylamino)anilino]-N-(4-ethoxyphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[4-(dimethylamino)anilino]-N-(4-ethoxyphenyl)pyridine-3-carboxamide
PubChem CID109164189
Molecular FormulaC22H24N4O2
Molecular Weight376.46 g/mol
Exact Mass376.19
IUPAC Name6-[4-(dimethylamino)anilino]-N-(4-ethoxyphenyl)pyridine-3-carboxamide
SMILESCCOc1ccc(NC(=O)c2ccc(Nc3ccc(N(C)C)cc3)nc2)cc1
InChIInChI=1S/C22H24N4O2/c1-4-28-20-12-8-18(9-13-20)25-22(27)16-5-14-21(23-15-16)24-17-6-10-19(11-7-17)26(2)3/h5-15H,4H2,1-3H3,(H,23,24)(H,25,27)
InChIKeyKEDQVNGIAVSVLS-UHFFFAOYSA-N
XLogP4.54
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 54.54
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

6-(4-acetamidoanilino)-N-(4-ethoxyphenyl)pyridine-3-carboxamide
CID 109164185
methyl 4-[[5-[(4-ethoxyphenyl)carbamoyl]-2-pyridinyl]amino]benzoate
CID 109164188
methyl 4-[[6-[4-(dimethylamino)anilino]pyridine-3-carbonyl]amino]benzoate
CID 109164647
N-[4-(dimethylamino)phenyl]-5-(4-ethoxyanilino)pyrazine-2-carboxamide
CID 109293760
N-(4-cyanophenyl)-6-[4-(dimethylamino)anilino]pyridine-3-carboxamide
CID 109164675
6-(3,4-difluoroanilino)-N-(4-ethoxyphenyl)pyridine-3-carboxamide
CID 109164202
N-(3,4-dimethoxyphenyl)-6-(4-ethoxyanilino)pyridine-3-carboxamide
CID 109164154
N-(3-chlorophenyl)-6-(4-ethoxyanilino)pyridine-3-carboxamide
CID 109163439
N-(3,4-dimethoxyphenyl)-6-[4-(dimethylamino)anilino]pyridine-3-carboxamide
CID 109164382
N-[4-(diethylamino)phenyl]-6-(4-methylanilino)pyridine-3-carboxamide
CID 109162272
2-N,5-N-bis(4-ethoxyphenyl)pyridine-2,5-dicarboxamide
CID 3252781
N-(2,3-dimethylphenyl)-6-(4-ethoxyanilino)pyridine-3-carboxamide
CID 109162787

Frequently Asked Questions

What is the IUPAC name of 6-[4-(dimethylamino)anilino]-N-(4-ethoxyphenyl)pyridine-3-carboxamide?
The IUPAC name of 6-[4-(dimethylamino)anilino]-N-(4-ethoxyphenyl)pyridine-3-carboxamide (CID 109164189) is 6-[4-(dimethylamino)anilino]-N-(4-ethoxyphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-[4-(dimethylamino)anilino]-N-(4-ethoxyphenyl)pyridine-3-carboxamide?
The canonical SMILES for 6-[4-(dimethylamino)anilino]-N-(4-ethoxyphenyl)pyridine-3-carboxamide is CCOc1ccc(NC(=O)c2ccc(Nc3ccc(N(C)C)cc3)nc2)cc1.
What is the InChIKey of 6-[4-(dimethylamino)anilino]-N-(4-ethoxyphenyl)pyridine-3-carboxamide?
The InChIKey is KEDQVNGIAVSVLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O2/c1-4-28-20-12-8-18(9-13-20)25-22(27)16-5-14-21(23-15-16)24-17-6-10-19(11-7-17)26(2)3/h5-15H,4H2,1-3H3,(H,23,24)(H,25,27).
What are the key properties of 6-[4-(dimethylamino)anilino]-N-(4-ethoxyphenyl)pyridine-3-carboxamide?
6-[4-(dimethylamino)anilino]-N-(4-ethoxyphenyl)pyridine-3-carboxamide has a molecular weight of 376.46 g/mol, XLogP of 4.54, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(dimethylamino)anilino]-N-(4-ethoxyphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 109164189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).