2-benzamido-N-(pyridin-2-ylmethylideneamino)benzamide

C20H16N4O2 — CID 4111465

IUPAC2-benzamido-N-(pyridin-2-ylmethylideneamino)benzamide
SMILESO=C(Nc1ccccc1C(=O)NN=Cc1ccccn1)c1ccccc1
InChIInChI=1S/C20H16N4O2/c25-19(15-8-2-1-3-9-15)23-18-12-5-4-11-17(18)20(26)24-22-14-16-10-6-7-13-21-16/h1-14H,(H,23,25)(H,24,26)
InChIKeyYVRDCUJZWLFQLO-UHFFFAOYSA-N
MW344.37 g/mol
LogP3.10
Rot. Bonds5

About 2-benzamido-N-(pyridin-2-ylmethylideneamino)benzamide

2-benzamido-N-(pyridin-2-ylmethylideneamino)benzamide (PubChem CID 4111465) has the molecular formula C20H16N4O2 and a molecular weight of 344.37 g/mol. Its IUPAC name is 2-benzamido-N-(pyridin-2-ylmethylideneamino)benzamide.

Molecular Properties

Compound Name2-benzamido-N-(pyridin-2-ylmethylideneamino)benzamide
PubChem CID4111465
Molecular FormulaC20H16N4O2
Molecular Weight344.37 g/mol
Exact Mass344.13
IUPAC Name2-benzamido-N-(pyridin-2-ylmethylideneamino)benzamide
SMILESO=C(Nc1ccccc1C(=O)NN=Cc1ccccn1)c1ccccc1
InChIInChI=1S/C20H16N4O2/c25-19(15-8-2-1-3-9-15)23-18-12-5-4-11-17(18)20(26)24-22-14-16-10-6-7-13-21-16/h1-14H,(H,23,25)(H,24,26)
InChIKeyYVRDCUJZWLFQLO-UHFFFAOYSA-N
XLogP3.10
TPSA83.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.37
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-[(4-nitrobenzoyl)amino]-N-[(E)-pyridin-2-ylmethylideneamino]benzamide
CID 46495533
4-hydroxy-N-[(Z)-pyridin-2-ylmethylideneamino]benzamide
CID 5402772
2-chloro-N-[(E)-pyridin-2-ylmethylideneamino]benzamide;dihydrate
CID 139147248
N-(pyridin-2-ylmethylideneamino)pyridine-3-carboxamide
CID 577497
2-nitro-N-(pyridin-2-ylmethylideneamino)benzamide
CID 4263662
2-benzamido-N-[(E)-1H-indol-3-ylmethylideneamino]benzamide
CID 135479703
2-benzamido-N-[(Z)-(5-bromo-2-hydroxyphenyl)methylideneamino]benzamide
CID 136677269
N-[2-[[(3-fluorophenyl)methylideneamino]carbamoyl]phenyl]pyridine-4-carboxamide
CID 66637933
N-[2-[[(3,4-dimethylphenyl)methylideneamino]carbamoyl]phenyl]pyridine-4-carboxamide
CID 66637366
2-N,6-N-bis[(Z)-pyridin-2-ylmethylideneamino]pyridine-2,6-dicarboxamide
CID 5437141
2-[(4-fluorobenzoyl)amino]-N-[(E)-(3-fluorophenyl)methylideneamino]benzamide
CID 23108146
N-[2-[[(E)-(3-fluorophenyl)methylideneamino]carbamoyl]phenyl]pyridine-3-carboxamide
CID 23107653

Frequently Asked Questions

What is the IUPAC name of 2-benzamido-N-(pyridin-2-ylmethylideneamino)benzamide?
The IUPAC name of 2-benzamido-N-(pyridin-2-ylmethylideneamino)benzamide (CID 4111465) is 2-benzamido-N-(pyridin-2-ylmethylideneamino)benzamide.
What is the SMILES notation for 2-benzamido-N-(pyridin-2-ylmethylideneamino)benzamide?
The canonical SMILES for 2-benzamido-N-(pyridin-2-ylmethylideneamino)benzamide is O=C(Nc1ccccc1C(=O)NN=Cc1ccccn1)c1ccccc1.
What is the InChIKey of 2-benzamido-N-(pyridin-2-ylmethylideneamino)benzamide?
The InChIKey is YVRDCUJZWLFQLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N4O2/c25-19(15-8-2-1-3-9-15)23-18-12-5-4-11-17(18)20(26)24-22-14-16-10-6-7-13-21-16/h1-14H,(H,23,25)(H,24,26).
What are the key properties of 2-benzamido-N-(pyridin-2-ylmethylideneamino)benzamide?
2-benzamido-N-(pyridin-2-ylmethylideneamino)benzamide has a molecular weight of 344.37 g/mol, XLogP of 3.10, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzamido-N-(pyridin-2-ylmethylideneamino)benzamide is sourced from PubChem (CID 4111465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).