N-(2-cyanophenyl)-4-(2-ethylanilino)pyridine-2-carboxamide

C21H18N4O — CID 109220187

IUPACN-(2-cyanophenyl)-4-(2-ethylanilino)pyridine-2-carboxamide
SMILESCCc1ccccc1Nc1ccnc(C(=O)Nc2ccccc2C#N)c1
InChIInChI=1S/C21H18N4O/c1-2-15-7-3-5-9-18(15)24-17-11-12-23-20(13-17)21(26)25-19-10-6-4-8-16(19)14-22/h3-13H,2H2,1H3,(H,23,24)(H,25,26)
InChIKeyJCUSOVRVOSXPAP-UHFFFAOYSA-N
MW342.40 g/mol
LogP4.51
Rot. Bonds5

About N-(2-cyanophenyl)-4-(2-ethylanilino)pyridine-2-carboxamide

N-(2-cyanophenyl)-4-(2-ethylanilino)pyridine-2-carboxamide (PubChem CID 109220187) has the molecular formula C21H18N4O and a molecular weight of 342.40 g/mol. Its IUPAC name is N-(2-cyanophenyl)-4-(2-ethylanilino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2-cyanophenyl)-4-(2-ethylanilino)pyridine-2-carboxamide
PubChem CID109220187
Molecular FormulaC21H18N4O
Molecular Weight342.40 g/mol
Exact Mass342.15
IUPAC NameN-(2-cyanophenyl)-4-(2-ethylanilino)pyridine-2-carboxamide
SMILESCCc1ccccc1Nc1ccnc(C(=O)Nc2ccccc2C#N)c1
InChIInChI=1S/C21H18N4O/c1-2-15-7-3-5-9-18(15)24-17-11-12-23-20(13-17)21(26)25-19-10-6-4-8-16(19)14-22/h3-13H,2H2,1H3,(H,23,24)(H,25,26)
InChIKeyJCUSOVRVOSXPAP-UHFFFAOYSA-N
XLogP4.51
TPSA77.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 54.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(2-cyanophenyl)-4-(2-ethylanilino)pyridine-2-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

4-(2-cyanoanilino)-N-(2-cyanophenyl)pyridine-2-carboxamide
CID 109222697
N-(2-cyanophenyl)-4-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide
CID 109222061
ethyl 2-[[2-[(2-cyanophenyl)carbamoyl]-4-pyridinyl]amino]benzoate
CID 109222691
N-(2-cyanophenyl)-4-(2,3-dichloroanilino)pyridine-2-carboxamide
CID 109222663
4-(5-chloro-2-methylanilino)-N-(2-cyanophenyl)pyridine-2-carboxamide
CID 109221189
4-(2-cyanoanilino)-N-(3,5-dimethylphenyl)pyridine-2-carboxamide
CID 109219956
4-(3-cyanoanilino)-N-(2-cyanophenyl)pyridine-2-carboxamide
CID 109222698
4-(2-cyanoanilino)-N-(2,5-dimethylphenyl)pyridine-2-carboxamide
CID 109219824
N-(4-chloro-2-methylphenyl)-4-(2-cyanoanilino)pyridine-2-carboxamide
CID 109221213
N-(2-cyanophenyl)-6-(2-ethylanilino)pyridazine-3-carboxamide
CID 109127922
N-(2-cyanophenyl)-4-(2,5-dimethoxyanilino)pyridine-2-carboxamide
CID 109221984
4-(2-cyanoanilino)-N-(3-methylphenyl)pyridine-2-carboxamide
CID 109219127

Frequently Asked Questions

What is the IUPAC name of N-(2-cyanophenyl)-4-(2-ethylanilino)pyridine-2-carboxamide?
The IUPAC name of N-(2-cyanophenyl)-4-(2-ethylanilino)pyridine-2-carboxamide (CID 109220187) is N-(2-cyanophenyl)-4-(2-ethylanilino)pyridine-2-carboxamide.
What is the SMILES notation for N-(2-cyanophenyl)-4-(2-ethylanilino)pyridine-2-carboxamide?
The canonical SMILES for N-(2-cyanophenyl)-4-(2-ethylanilino)pyridine-2-carboxamide is CCc1ccccc1Nc1ccnc(C(=O)Nc2ccccc2C#N)c1.
What is the InChIKey of N-(2-cyanophenyl)-4-(2-ethylanilino)pyridine-2-carboxamide?
The InChIKey is JCUSOVRVOSXPAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N4O/c1-2-15-7-3-5-9-18(15)24-17-11-12-23-20(13-17)21(26)25-19-10-6-4-8-16(19)14-22/h3-13H,2H2,1H3,(H,23,24)(H,25,26).
What are the key properties of N-(2-cyanophenyl)-4-(2-ethylanilino)pyridine-2-carboxamide?
N-(2-cyanophenyl)-4-(2-ethylanilino)pyridine-2-carboxamide has a molecular weight of 342.40 g/mol, XLogP of 4.51, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanophenyl)-4-(2-ethylanilino)pyridine-2-carboxamide is sourced from PubChem (CID 109220187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).