6-[benzyl(methyl)amino]-N-[4-(diethylamino)phenyl]pyridine-3-carboxamide

C24H28N4O — CID 109156325

IUPAC6-[benzyl(methyl)amino]-N-[4-(diethylamino)phenyl]pyridine-3-carboxamide
SMILESCCN(CC)c1ccc(NC(=O)c2ccc(N(C)Cc3ccccc3)nc2)cc1
InChIInChI=1S/C24H28N4O/c1-4-28(5-2)22-14-12-21(13-15-22)26-24(29)20-11-16-23(25-17-20)27(3)18-19-9-7-6-8-10-19/h6-17H,4-5,18H2,1-3H3,(H,26,29)
InChIKeyPUMDVWBJDWYGPO-UHFFFAOYSA-N
MW388.52 g/mol
LogP4.82
Rot. Bonds8

About 6-[benzyl(methyl)amino]-N-[4-(diethylamino)phenyl]pyridine-3-carboxamide

6-[benzyl(methyl)amino]-N-[4-(diethylamino)phenyl]pyridine-3-carboxamide (PubChem CID 109156325) has the molecular formula C24H28N4O and a molecular weight of 388.52 g/mol. Its IUPAC name is 6-[benzyl(methyl)amino]-N-[4-(diethylamino)phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[benzyl(methyl)amino]-N-[4-(diethylamino)phenyl]pyridine-3-carboxamide
PubChem CID109156325
Molecular FormulaC24H28N4O
Molecular Weight388.52 g/mol
Exact Mass388.23
IUPAC Name6-[benzyl(methyl)amino]-N-[4-(diethylamino)phenyl]pyridine-3-carboxamide
SMILESCCN(CC)c1ccc(NC(=O)c2ccc(N(C)Cc3ccccc3)nc2)cc1
InChIInChI=1S/C24H28N4O/c1-4-28(5-2)22-14-12-21(13-15-22)26-24(29)20-11-16-23(25-17-20)27(3)18-19-9-7-6-8-10-19/h6-17H,4-5,18H2,1-3H3,(H,26,29)
InChIKeyPUMDVWBJDWYGPO-UHFFFAOYSA-N
XLogP4.82
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.52
LogP ≤ 54.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

6-[benzyl(methyl)amino]-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide
CID 109156294
6-[benzyl(methyl)amino]-N-quinolin-3-ylpyridine-3-carboxamide
CID 10451671
6-[benzyl(methyl)amino]-N-(3-chloro-4-fluorophenyl)pyridine-3-carboxamide
CID 109156302
N-[6-[benzyl(ethyl)amino]-3-pyridinyl]-4-methylbenzamide
CID 113012579
6-[benzyl(methyl)amino]-N-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide
CID 109156314
N-[4-(diethylamino)phenyl]-6-fluoropyridine-3-carboxamide
CID 63973943
6-[benzyl(ethyl)amino]-N-butan-2-ylpyridine-3-carboxamide
CID 109152040
methyl 4-[[6-(diethylamino)pyridine-3-carbonyl]amino]benzoate
CID 48650816
N-benzyl-6-[4-(diethylamino)anilino]-N-methylpyridine-3-carboxamide
CID 109156408
N-[4-[benzyl(ethyl)amino]phenyl]-4-methoxybenzamide
CID 112982849
2-[benzyl(ethyl)amino]-N-(4-ethoxyphenyl)pyrimidine-5-carboxamide
CID 109258493
N-[4-(diethylamino)phenyl]-5-(N-methylanilino)pyrazine-2-carboxamide
CID 109290357

Frequently Asked Questions

What is the IUPAC name of 6-[benzyl(methyl)amino]-N-[4-(diethylamino)phenyl]pyridine-3-carboxamide?
The IUPAC name of 6-[benzyl(methyl)amino]-N-[4-(diethylamino)phenyl]pyridine-3-carboxamide (CID 109156325) is 6-[benzyl(methyl)amino]-N-[4-(diethylamino)phenyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-[benzyl(methyl)amino]-N-[4-(diethylamino)phenyl]pyridine-3-carboxamide?
The canonical SMILES for 6-[benzyl(methyl)amino]-N-[4-(diethylamino)phenyl]pyridine-3-carboxamide is CCN(CC)c1ccc(NC(=O)c2ccc(N(C)Cc3ccccc3)nc2)cc1.
What is the InChIKey of 6-[benzyl(methyl)amino]-N-[4-(diethylamino)phenyl]pyridine-3-carboxamide?
The InChIKey is PUMDVWBJDWYGPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N4O/c1-4-28(5-2)22-14-12-21(13-15-22)26-24(29)20-11-16-23(25-17-20)27(3)18-19-9-7-6-8-10-19/h6-17H,4-5,18H2,1-3H3,(H,26,29).
What are the key properties of 6-[benzyl(methyl)amino]-N-[4-(diethylamino)phenyl]pyridine-3-carboxamide?
6-[benzyl(methyl)amino]-N-[4-(diethylamino)phenyl]pyridine-3-carboxamide has a molecular weight of 388.52 g/mol, XLogP of 4.82, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[benzyl(methyl)amino]-N-[4-(diethylamino)phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 109156325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).