2-anilino-N-(pyridin-4-ylmethyl)benzamide

C19H17N3O — CID 17396496

IUPAC2-anilino-N-(pyridin-4-ylmethyl)benzamide
SMILESO=C(NCc1ccncc1)c1ccccc1Nc1ccccc1
InChIInChI=1S/C19H17N3O/c23-19(21-14-15-10-12-20-13-11-15)17-8-4-5-9-18(17)22-16-6-2-1-3-7-16/h1-13,22H,14H2,(H,21,23)
InChIKeyGDFJBVOBMWGWMN-UHFFFAOYSA-N
MW303.37 g/mol
LogP3.76
Rot. Bonds5

About 2-anilino-N-(pyridin-4-ylmethyl)benzamide

2-anilino-N-(pyridin-4-ylmethyl)benzamide (PubChem CID 17396496) has the molecular formula C19H17N3O and a molecular weight of 303.37 g/mol. Its IUPAC name is 2-anilino-N-(pyridin-4-ylmethyl)benzamide.

Molecular Properties

Compound Name2-anilino-N-(pyridin-4-ylmethyl)benzamide
PubChem CID17396496
Molecular FormulaC19H17N3O
Molecular Weight303.37 g/mol
Exact Mass303.14
IUPAC Name2-anilino-N-(pyridin-4-ylmethyl)benzamide
SMILESO=C(NCc1ccncc1)c1ccccc1Nc1ccccc1
InChIInChI=1S/C19H17N3O/c23-19(21-14-15-10-12-20-13-11-15)17-8-4-5-9-18(17)22-16-6-2-1-3-7-16/h1-13,22H,14H2,(H,21,23)
InChIKeyGDFJBVOBMWGWMN-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

N-benzyl-2-(pyridin-4-ylamino)benzamide
CID 24821329
2-(propan-2-ylamino)-N-(pyridin-4-ylmethyl)benzamide
CID 63107619
N-benzyl-2-(2-methylanilino)benzamide
CID 23737672
5-anilino-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 109235531
N-[2-(pyridin-4-ylmethylcarbamoyl)phenyl]thiophene-2-carboxamide
CID 24653521
2-anilino-N-(2-pyridin-3-ylethyl)benzamide
CID 36866409
2-[4-(benzylcarbamoyl)anilino]benzoic acid
CID 51066167
N-benzyl-2-(phenylcarbamoylamino)benzamide
CID 895604
2-(4-methoxyanilino)-N-[[3-methoxy-4-(pyridin-4-ylmethoxy)phenyl]methyl]benzamide
CID 55844320
N-[(4-acetamidophenyl)methyl]-2-(4-fluoroanilino)benzamide
CID 18153818
2-benzylselanyl-N-(pyridin-4-ylmethyl)benzamide
CID 19898974
N-(3-phenylpropyl)-2-(pyridin-4-ylmethylamino)benzamide
CID 15462164

Frequently Asked Questions

What is the IUPAC name of 2-anilino-N-(pyridin-4-ylmethyl)benzamide?
The IUPAC name of 2-anilino-N-(pyridin-4-ylmethyl)benzamide (CID 17396496) is 2-anilino-N-(pyridin-4-ylmethyl)benzamide.
What is the SMILES notation for 2-anilino-N-(pyridin-4-ylmethyl)benzamide?
The canonical SMILES for 2-anilino-N-(pyridin-4-ylmethyl)benzamide is O=C(NCc1ccncc1)c1ccccc1Nc1ccccc1.
What is the InChIKey of 2-anilino-N-(pyridin-4-ylmethyl)benzamide?
The InChIKey is GDFJBVOBMWGWMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O/c23-19(21-14-15-10-12-20-13-11-15)17-8-4-5-9-18(17)22-16-6-2-1-3-7-16/h1-13,22H,14H2,(H,21,23).
What are the key properties of 2-anilino-N-(pyridin-4-ylmethyl)benzamide?
2-anilino-N-(pyridin-4-ylmethyl)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 2-anilino-N-(pyridin-4-ylmethyl)benzamide is sourced from PubChem (CID 17396496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).