N-[4-(diethylamino)phenyl]-2-[(2-methylphenyl)methylamino]pyridine-4-carboxamide

C24H28N4O — CID 109169732

IUPACN-[4-(diethylamino)phenyl]-2-[(2-methylphenyl)methylamino]pyridine-4-carboxamide
SMILESCCN(CC)c1ccc(NC(=O)c2ccnc(NCc3ccccc3C)c2)cc1
InChIInChI=1S/C24H28N4O/c1-4-28(5-2)22-12-10-21(11-13-22)27-24(29)19-14-15-25-23(16-19)26-17-20-9-7-6-8-18(20)3/h6-16H,4-5,17H2,1-3H3,(H,25,26)(H,27,29)
InChIKeyLVOGHPSDRDOGMC-UHFFFAOYSA-N
MW388.52 g/mol
LogP5.10
Rot. Bonds8

About N-[4-(diethylamino)phenyl]-2-[(2-methylphenyl)methylamino]pyridine-4-carboxamide

N-[4-(diethylamino)phenyl]-2-[(2-methylphenyl)methylamino]pyridine-4-carboxamide (PubChem CID 109169732) has the molecular formula C24H28N4O and a molecular weight of 388.52 g/mol. Its IUPAC name is N-[4-(diethylamino)phenyl]-2-[(2-methylphenyl)methylamino]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[4-(diethylamino)phenyl]-2-[(2-methylphenyl)methylamino]pyridine-4-carboxamide
PubChem CID109169732
Molecular FormulaC24H28N4O
Molecular Weight388.52 g/mol
Exact Mass388.23
IUPAC NameN-[4-(diethylamino)phenyl]-2-[(2-methylphenyl)methylamino]pyridine-4-carboxamide
SMILESCCN(CC)c1ccc(NC(=O)c2ccnc(NCc3ccccc3C)c2)cc1
InChIInChI=1S/C24H28N4O/c1-4-28(5-2)22-12-10-21(11-13-22)27-24(29)19-14-15-25-23(16-19)26-17-20-9-7-6-8-18(20)3/h6-16H,4-5,17H2,1-3H3,(H,25,26)(H,27,29)
InChIKeyLVOGHPSDRDOGMC-UHFFFAOYSA-N
XLogP5.10
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500388.52
LogP ≤ 55.10
H-Bond Donors ≤ 52
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

N-[4-(diethylamino)phenyl]-2-(2-methylanilino)pyridine-4-carboxamide
CID 109176212
N-(3,4-difluorophenyl)-2-[(2-methylphenyl)methylamino]pyridine-4-carboxamide
CID 109169746
2-anilino-N-[4-(diethylamino)phenyl]pyridine-4-carboxamide
CID 109176141
N-[4-(diethylamino)phenyl]-2-[(4-fluorophenyl)methylamino]pyridine-4-carboxamide
CID 109170697
N-(3-chloro-4-fluorophenyl)-2-[(2-methylphenyl)methylamino]pyridine-4-carboxamide
CID 109169709
N-(3-chloro-4-methoxyphenyl)-2-[(2-methylphenyl)methylamino]pyridine-4-carboxamide
CID 109169710
N-[2-(dimethylamino)ethyl]-2-[(2-methylphenyl)methylamino]pyridine-4-carboxamide
CID 109167652
N-(4-chlorophenyl)-2-[(2-chlorophenyl)methylamino]pyridine-4-carboxamide
CID 109170825
N-(4-acetylphenyl)-2-[(2-chlorophenyl)methylamino]pyridine-4-carboxamide
CID 109170839
N-[4-(dimethylamino)phenyl]-2-(ethylamino)pyridine-4-carboxamide
CID 62168755
2-amino-N-[4-(diethylamino)phenyl]pyridine-4-carboxamide
CID 63180905
N-(4-chlorophenyl)-2-[(2-methoxyphenyl)methylamino]pyridine-4-carboxamide
CID 109171137

Frequently Asked Questions

What is the IUPAC name of N-[4-(diethylamino)phenyl]-2-[(2-methylphenyl)methylamino]pyridine-4-carboxamide?
The IUPAC name of N-[4-(diethylamino)phenyl]-2-[(2-methylphenyl)methylamino]pyridine-4-carboxamide (CID 109169732) is N-[4-(diethylamino)phenyl]-2-[(2-methylphenyl)methylamino]pyridine-4-carboxamide.
What is the SMILES notation for N-[4-(diethylamino)phenyl]-2-[(2-methylphenyl)methylamino]pyridine-4-carboxamide?
The canonical SMILES for N-[4-(diethylamino)phenyl]-2-[(2-methylphenyl)methylamino]pyridine-4-carboxamide is CCN(CC)c1ccc(NC(=O)c2ccnc(NCc3ccccc3C)c2)cc1.
What is the InChIKey of N-[4-(diethylamino)phenyl]-2-[(2-methylphenyl)methylamino]pyridine-4-carboxamide?
The InChIKey is LVOGHPSDRDOGMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N4O/c1-4-28(5-2)22-12-10-21(11-13-22)27-24(29)19-14-15-25-23(16-19)26-17-20-9-7-6-8-18(20)3/h6-16H,4-5,17H2,1-3H3,(H,25,26)(H,27,29).
What are the key properties of N-[4-(diethylamino)phenyl]-2-[(2-methylphenyl)methylamino]pyridine-4-carboxamide?
N-[4-(diethylamino)phenyl]-2-[(2-methylphenyl)methylamino]pyridine-4-carboxamide has a molecular weight of 388.52 g/mol, XLogP of 5.10, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(diethylamino)phenyl]-2-[(2-methylphenyl)methylamino]pyridine-4-carboxamide is sourced from PubChem (CID 109169732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).