N-benzyl-2-(pyridin-4-ylamino)benzamide

C19H17N3O — CID 24821329

IUPACN-benzyl-2-(pyridin-4-ylamino)benzamide
SMILESO=C(NCc1ccccc1)c1ccccc1Nc1ccncc1
InChIInChI=1S/C19H17N3O/c23-19(21-14-15-6-2-1-3-7-15)17-8-4-5-9-18(17)22-16-10-12-20-13-11-16/h1-13H,14H2,(H,20,22)(H,21,23)
InChIKeyOPIGALRIHVZYIM-UHFFFAOYSA-N
MW303.37 g/mol
LogP3.76
Rot. Bonds5

About N-benzyl-2-(pyridin-4-ylamino)benzamide

N-benzyl-2-(pyridin-4-ylamino)benzamide (PubChem CID 24821329) has the molecular formula C19H17N3O and a molecular weight of 303.37 g/mol. Its IUPAC name is N-benzyl-2-(pyridin-4-ylamino)benzamide.

Molecular Properties

Compound NameN-benzyl-2-(pyridin-4-ylamino)benzamide
PubChem CID24821329
Molecular FormulaC19H17N3O
Molecular Weight303.37 g/mol
Exact Mass303.14
IUPAC NameN-benzyl-2-(pyridin-4-ylamino)benzamide
SMILESO=C(NCc1ccccc1)c1ccccc1Nc1ccncc1
InChIInChI=1S/C19H17N3O/c23-19(21-14-15-6-2-1-3-7-15)17-8-4-5-9-18(17)22-16-10-12-20-13-11-16/h1-13H,14H2,(H,20,22)(H,21,23)
InChIKeyOPIGALRIHVZYIM-UHFFFAOYSA-N
XLogP3.76
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.37
LogP ≤ 53.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-anilino-N-(pyridin-4-ylmethyl)benzamide
CID 17396496
N-benzyl-2-(2-methylanilino)benzamide
CID 23737672
2-[4-(benzylcarbamoyl)anilino]benzoic acid
CID 51066167
2-(propan-2-ylamino)-N-(pyridin-4-ylmethyl)benzamide
CID 63107619
2-anilino-N-(2-pyridin-3-ylethyl)benzamide
CID 36866409
N-benzyl-2-[(4,6-dimethylpyrimidin-2-yl)amino]benzamide
CID 100779345
N-benzyl-2-(phenylcarbamoylamino)benzamide
CID 895604
N-benzylpyridine-4-carboxamide;hydrochloride
CID 110755427
1-[2-(pyridin-4-ylamino)phenyl]ethanone
CID 82536637
N-[(4-acetamidophenyl)methyl]-2-(4-fluoroanilino)benzamide
CID 18153818
2-benzylselanyl-N-(pyridin-4-ylmethyl)benzamide
CID 19898974
N-[2-(pyridin-4-ylmethylcarbamoyl)phenyl]thiophene-2-carboxamide
CID 24653521

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-(pyridin-4-ylamino)benzamide?
The IUPAC name of N-benzyl-2-(pyridin-4-ylamino)benzamide (CID 24821329) is N-benzyl-2-(pyridin-4-ylamino)benzamide.
What is the SMILES notation for N-benzyl-2-(pyridin-4-ylamino)benzamide?
The canonical SMILES for N-benzyl-2-(pyridin-4-ylamino)benzamide is O=C(NCc1ccccc1)c1ccccc1Nc1ccncc1.
What is the InChIKey of N-benzyl-2-(pyridin-4-ylamino)benzamide?
The InChIKey is OPIGALRIHVZYIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O/c23-19(21-14-15-6-2-1-3-7-15)17-8-4-5-9-18(17)22-16-10-12-20-13-11-16/h1-13H,14H2,(H,20,22)(H,21,23).
What are the key properties of N-benzyl-2-(pyridin-4-ylamino)benzamide?
N-benzyl-2-(pyridin-4-ylamino)benzamide has a molecular weight of 303.37 g/mol, XLogP of 3.76, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-(pyridin-4-ylamino)benzamide is sourced from PubChem (CID 24821329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).