N-(4-ethyl-2-pyridinyl)-4-pyridin-3-ylbenzamide

C19H17N3O — CID 59781573

IUPACN-(4-ethyl-2-pyridinyl)-4-pyridin-3-ylbenzamide
SMILESCCc1ccnc(NC(=O)c2ccc(-c3cccnc3)cc2)c1
InChIInChI=1S/C19H17N3O/c1-2-14-9-11-21-18(12-14)22-19(23)16-7-5-15(6-8-16)17-4-3-10-20-13-17/h3-13H,2H2,1H3,(H,21,22,23)
InChIKeyOXIFCLOUAXLYAS-UHFFFAOYSA-N
MW303.37 g/mol
LogP3.96
Rot. Bonds4

About N-(4-ethyl-2-pyridinyl)-4-pyridin-3-ylbenzamide

N-(4-ethyl-2-pyridinyl)-4-pyridin-3-ylbenzamide (PubChem CID 59781573) has the molecular formula C19H17N3O and a molecular weight of 303.37 g/mol. Its IUPAC name is N-(4-ethyl-2-pyridinyl)-4-pyridin-3-ylbenzamide.

Molecular Properties

Compound NameN-(4-ethyl-2-pyridinyl)-4-pyridin-3-ylbenzamide
PubChem CID59781573
Molecular FormulaC19H17N3O
Molecular Weight303.37 g/mol
Exact Mass303.14
IUPAC NameN-(4-ethyl-2-pyridinyl)-4-pyridin-3-ylbenzamide
SMILESCCc1ccnc(NC(=O)c2ccc(-c3cccnc3)cc2)c1
InChIInChI=1S/C19H17N3O/c1-2-14-9-11-21-18(12-14)22-19(23)16-7-5-15(6-8-16)17-4-3-10-20-13-17/h3-13H,2H2,1H3,(H,21,22,23)
InChIKeyOXIFCLOUAXLYAS-UHFFFAOYSA-N
XLogP3.96
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.37
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl 2-(pyridine-3-carbonylamino)pyridine-4-carboxylate
CID 108755424
5-[(4-pyridin-3-ylbenzoyl)amino]benzene-1,3-dicarboxylic acid
CID 146021058
N-(2-chloro-3-pyridinyl)-4-pyridin-3-ylbenzamide
CID 59673856
N-(2-hydroxyphenyl)-4-pyridin-3-ylbenzamide
CID 59672983
N-[(3,4-diethoxyphenyl)methyl]-4-pyridin-3-ylbenzamide
CID 50831636
N-(3-pyridin-3-ylphenyl)-4-pyrimidin-5-ylbenzamide
CID 25058459
4-chloro-N-[4-(hydroxymethyl)-2-pyridinyl]benzamide
CID 82343541
N-[3-(2-benzamido-4-pyridinyl)-1,1,1-trifluoropropan-2-yl]oxypyridine-3-carboxamide
CID 140671075
N-(4-ethyl-2-pyridinyl)-5-hydroxy-2-methylpyridine-4-carboxamide
CID 155917131
N'-(4-pentoxybenzoyl)-4-pyridin-3-ylbenzohydrazide
CID 58858349
4-(3-chloro-2-pyridinyl)-N-(4-ethyl-2-pyridinyl)-2-fluorobenzamide
CID 11451124
N'-(4-bromobenzoyl)-4-pyridin-3-ylbenzohydrazide
CID 58858311

Frequently Asked Questions

What is the IUPAC name of N-(4-ethyl-2-pyridinyl)-4-pyridin-3-ylbenzamide?
The IUPAC name of N-(4-ethyl-2-pyridinyl)-4-pyridin-3-ylbenzamide (CID 59781573) is N-(4-ethyl-2-pyridinyl)-4-pyridin-3-ylbenzamide.
What is the SMILES notation for N-(4-ethyl-2-pyridinyl)-4-pyridin-3-ylbenzamide?
The canonical SMILES for N-(4-ethyl-2-pyridinyl)-4-pyridin-3-ylbenzamide is CCc1ccnc(NC(=O)c2ccc(-c3cccnc3)cc2)c1.
What is the InChIKey of N-(4-ethyl-2-pyridinyl)-4-pyridin-3-ylbenzamide?
The InChIKey is OXIFCLOUAXLYAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O/c1-2-14-9-11-21-18(12-14)22-19(23)16-7-5-15(6-8-16)17-4-3-10-20-13-17/h3-13H,2H2,1H3,(H,21,22,23).
What are the key properties of N-(4-ethyl-2-pyridinyl)-4-pyridin-3-ylbenzamide?
N-(4-ethyl-2-pyridinyl)-4-pyridin-3-ylbenzamide has a molecular weight of 303.37 g/mol, XLogP of 3.96, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethyl-2-pyridinyl)-4-pyridin-3-ylbenzamide is sourced from PubChem (CID 59781573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).