N-(4-aminophenyl)-N-ethyl-2,6-dimethylpyridine-3-carboxamide

C16H19N3O — CID 63234084

IUPACN-(4-aminophenyl)-N-ethyl-2,6-dimethylpyridine-3-carboxamide
SMILESCCN(C(=O)c1ccc(C)nc1C)c1ccc(N)cc1
InChIInChI=1S/C16H19N3O/c1-4-19(14-8-6-13(17)7-9-14)16(20)15-10-5-11(2)18-12(15)3/h5-10H,4,17H2,1-3H3
InChIKeyLJEWMIZOXMDVKC-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.95
Rot. Bonds3

About N-(4-aminophenyl)-N-ethyl-2,6-dimethylpyridine-3-carboxamide

N-(4-aminophenyl)-N-ethyl-2,6-dimethylpyridine-3-carboxamide (PubChem CID 63234084) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is N-(4-aminophenyl)-N-ethyl-2,6-dimethylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-aminophenyl)-N-ethyl-2,6-dimethylpyridine-3-carboxamide
PubChem CID63234084
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC NameN-(4-aminophenyl)-N-ethyl-2,6-dimethylpyridine-3-carboxamide
SMILESCCN(C(=O)c1ccc(C)nc1C)c1ccc(N)cc1
InChIInChI=1S/C16H19N3O/c1-4-19(14-8-6-13(17)7-9-14)16(20)15-10-5-11(2)18-12(15)3/h5-10H,4,17H2,1-3H3
InChIKeyLJEWMIZOXMDVKC-UHFFFAOYSA-N
XLogP2.95
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(4-aminophenyl)-N-ethyl-2,5-dimethylfuran-3-carboxamide
CID 55175946
N-[(4-aminophenyl)methyl]-2,6-dimethylpyridine-3-carboxamide
CID 62830418
N-(4-aminophenyl)-4-bromo-N-ethyl-2-fluorobenzamide
CID 63230469
2,6-dimethyl-N,N-dipropylpyridine-3-carboxamide
CID 87024383
N-(4-aminophenyl)-5-chloro-N-ethyl-2-fluorobenzamide
CID 63230338
N-(2-cyanoethyl)-2,6-dimethyl-N-phenylpyridine-3-carboxamide
CID 62830086
N-butyl-N-ethyl-2,6-dimethylpyridine-3-carboxamide
CID 87011265
N-(4-aminophenyl)-4-bromo-N-ethyl-2-methoxybenzamide
CID 115368567
N-(3-amino-2-methylpropyl)-N-ethyl-2,6-dimethylpyridine-3-carboxamide
CID 62829546
N-(4-aminophenyl)-N-ethyl-1H-pyrazole-4-carboxamide
CID 63234213
2,6-dimethylpyridine-3-carboxamide
CID 2824850
N-(4-aminophenyl)-N-ethyl-2-(3-methylphenyl)acetamide
CID 63234126

Frequently Asked Questions

What is the IUPAC name of N-(4-aminophenyl)-N-ethyl-2,6-dimethylpyridine-3-carboxamide?
The IUPAC name of N-(4-aminophenyl)-N-ethyl-2,6-dimethylpyridine-3-carboxamide (CID 63234084) is N-(4-aminophenyl)-N-ethyl-2,6-dimethylpyridine-3-carboxamide.
What is the SMILES notation for N-(4-aminophenyl)-N-ethyl-2,6-dimethylpyridine-3-carboxamide?
The canonical SMILES for N-(4-aminophenyl)-N-ethyl-2,6-dimethylpyridine-3-carboxamide is CCN(C(=O)c1ccc(C)nc1C)c1ccc(N)cc1.
What is the InChIKey of N-(4-aminophenyl)-N-ethyl-2,6-dimethylpyridine-3-carboxamide?
The InChIKey is LJEWMIZOXMDVKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-4-19(14-8-6-13(17)7-9-14)16(20)15-10-5-11(2)18-12(15)3/h5-10H,4,17H2,1-3H3.
What are the key properties of N-(4-aminophenyl)-N-ethyl-2,6-dimethylpyridine-3-carboxamide?
N-(4-aminophenyl)-N-ethyl-2,6-dimethylpyridine-3-carboxamide has a molecular weight of 269.35 g/mol, XLogP of 2.95, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminophenyl)-N-ethyl-2,6-dimethylpyridine-3-carboxamide is sourced from PubChem (CID 63234084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).