N-[[4-(N-methylanilino)phenyl]methylideneamino]pyridine-4-carboxamide

C20H18N4O — CID 5149584

IUPACN-[[4-(N-methylanilino)phenyl]methylideneamino]pyridine-4-carboxamide
SMILESCN(c1ccccc1)c1ccc(C=NNC(=O)c2ccncc2)cc1
InChIInChI=1S/C20H18N4O/c1-24(18-5-3-2-4-6-18)19-9-7-16(8-10-19)15-22-23-20(25)17-11-13-21-14-12-17/h2-15H,1H3,(H,23,25)
InChIKeyOHNBHMJVVINITR-UHFFFAOYSA-N
MW330.39 g/mol
LogP3.61
Rot. Bonds5

About N-[[4-(N-methylanilino)phenyl]methylideneamino]pyridine-4-carboxamide

N-[[4-(N-methylanilino)phenyl]methylideneamino]pyridine-4-carboxamide (PubChem CID 5149584) has the molecular formula C20H18N4O and a molecular weight of 330.39 g/mol. Its IUPAC name is N-[[4-(N-methylanilino)phenyl]methylideneamino]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[[4-(N-methylanilino)phenyl]methylideneamino]pyridine-4-carboxamide
PubChem CID5149584
Molecular FormulaC20H18N4O
Molecular Weight330.39 g/mol
Exact Mass330.15
IUPAC NameN-[[4-(N-methylanilino)phenyl]methylideneamino]pyridine-4-carboxamide
SMILESCN(c1ccccc1)c1ccc(C=NNC(=O)c2ccncc2)cc1
InChIInChI=1S/C20H18N4O/c1-24(18-5-3-2-4-6-18)19-9-7-16(8-10-19)15-22-23-20(25)17-11-13-21-14-12-17/h2-15H,1H3,(H,23,25)
InChIKeyOHNBHMJVVINITR-UHFFFAOYSA-N
XLogP3.61
TPSA57.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.39
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-[[4-(N-methylanilino)phenyl]methylideneamino]pyridine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(E)-[4-(dimethylamino)phenyl]methylideneamino]pyridine-4-carboxamide;hydrate
CID 21230438
4-methoxy-N-[[4-(N-methylanilino)phenyl]methylideneamino]benzamide
CID 1039675
N-[[4-[(pyridine-4-carbonylhydrazinylidene)methyl]phenyl]methylideneamino]pyridine-4-carboxamide
CID 1101714
N-[(E)-(4-phenylmethoxyphenyl)methylideneamino]pyridine-4-carboxamide
CID 6868906
N-[(E)-(4-bromophenyl)methylideneamino]pyridine-4-carboxamide
CID 5332577
N-[(E)-[4-(4-methylphenoxy)phenyl]methylideneamino]pyridine-4-carboxamide
CID 51042560
N-[(E)-(4-chlorophenyl)methylideneamino]pyridine-4-carboxamide;hydrate
CID 21204570
4-[(4-chlorophenyl)methoxy]-N-[(Z)-[4-(N-methylanilino)phenyl]methylideneamino]benzamide
CID 6307220
3-hydroxy-N-[(E)-[4-(N-methylanilino)phenyl]methylideneamino]naphthalene-2-carboxamide
CID 6903267
ethyl N-[(Z)-[4-(N-methylanilino)phenyl]methylideneamino]carbamate
CID 6268460
ethyl N-[[4-(N-methylanilino)phenyl]methylideneamino]carbamate
CID 5093637
3-(dimethylamino)-N-[4-[[(E)-pyridin-4-ylmethylideneamino]carbamoyl]phenyl]benzamide
CID 90642883

Frequently Asked Questions

What is the IUPAC name of N-[[4-(N-methylanilino)phenyl]methylideneamino]pyridine-4-carboxamide?
The IUPAC name of N-[[4-(N-methylanilino)phenyl]methylideneamino]pyridine-4-carboxamide (CID 5149584) is N-[[4-(N-methylanilino)phenyl]methylideneamino]pyridine-4-carboxamide.
What is the SMILES notation for N-[[4-(N-methylanilino)phenyl]methylideneamino]pyridine-4-carboxamide?
The canonical SMILES for N-[[4-(N-methylanilino)phenyl]methylideneamino]pyridine-4-carboxamide is CN(c1ccccc1)c1ccc(C=NNC(=O)c2ccncc2)cc1.
What is the InChIKey of N-[[4-(N-methylanilino)phenyl]methylideneamino]pyridine-4-carboxamide?
The InChIKey is OHNBHMJVVINITR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N4O/c1-24(18-5-3-2-4-6-18)19-9-7-16(8-10-19)15-22-23-20(25)17-11-13-21-14-12-17/h2-15H,1H3,(H,23,25).
What are the key properties of N-[[4-(N-methylanilino)phenyl]methylideneamino]pyridine-4-carboxamide?
N-[[4-(N-methylanilino)phenyl]methylideneamino]pyridine-4-carboxamide has a molecular weight of 330.39 g/mol, XLogP of 3.61, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(N-methylanilino)phenyl]methylideneamino]pyridine-4-carboxamide is sourced from PubChem (CID 5149584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).