N-[(Z)-[amino(pyridin-2-yl)methylidene]amino]-2-hydroxybenzamide

C13H12N4O2 — CID 15777277

IUPACN-[(Z)-[amino(pyridin-2-yl)methylidene]amino]-2-hydroxybenzamide
SMILESN/C(=N\NC(=O)c1ccccc1O)c1ccccn1
InChIInChI=1S/C13H12N4O2/c14-12(10-6-3-4-8-15-10)16-17-13(19)9-5-1-2-7-11(9)18/h1-8,18H,(H2,14,16)(H,17,19)
InChIKeyOXIXIKUEJFIPRA-UHFFFAOYSA-N
MW256.27 g/mol
LogP0.84
Rot. Bonds3

About N-[(Z)-[amino(pyridin-2-yl)methylidene]amino]-2-hydroxybenzamide

N-[(Z)-[amino(pyridin-2-yl)methylidene]amino]-2-hydroxybenzamide (PubChem CID 15777277) has the molecular formula C13H12N4O2 and a molecular weight of 256.27 g/mol. Its IUPAC name is N-[(Z)-[amino(pyridin-2-yl)methylidene]amino]-2-hydroxybenzamide.

Molecular Properties

Compound NameN-[(Z)-[amino(pyridin-2-yl)methylidene]amino]-2-hydroxybenzamide
PubChem CID15777277
Molecular FormulaC13H12N4O2
Molecular Weight256.27 g/mol
Exact Mass256.10
IUPAC NameN-[(Z)-[amino(pyridin-2-yl)methylidene]amino]-2-hydroxybenzamide
SMILESN/C(=N\NC(=O)c1ccccc1O)c1ccccn1
InChIInChI=1S/C13H12N4O2/c14-12(10-6-3-4-8-15-10)16-17-13(19)9-5-1-2-7-11(9)18/h1-8,18H,(H2,14,16)(H,17,19)
InChIKeyOXIXIKUEJFIPRA-UHFFFAOYSA-N
XLogP0.84
TPSA100.60 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.27
LogP ≤ 50.84
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-hydroxy-N-[(E)-[phenyl(pyridin-2-yl)methylidene]amino]benzamide
CID 6262559
N-[[amino(pyridin-2-yl)methylidene]amino]-2-phenylacetamide
CID 4749358
2,4-dihydroxy-N-(1-pyridin-2-ylethylideneamino)benzamide
CID 872905
5-chloro-2-hydroxy-N-[(Z)-1-pyridin-2-ylethylideneamino]benzamide
CID 5416440
2-hydroxy-5-iodo-N-(1-pyridin-2-ylethylideneamino)benzamide
CID 1352694
2-hydroxy-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide
CID 135472588
2-fluoro-N-[[phenyl(pyridin-2-yl)methylidene]amino]benzamide
CID 4536302
N-(benzhydrylideneamino)-2-hydroxybenzamide
CID 24574931
N'-(pyridin-2-ylamino)pyridine-2-carboximidamide
CID 139161473
N-[(Z)-1-(2-hydroxyphenyl)ethylideneamino]pyrazine-2-carboxamide
CID 135656292
(2-hydroxyphenyl)-[4-(pyridine-2-carbonyl)piperazin-1-yl]methanone
CID 108534823
N-[(E)-[amino-(2-hydroxyphenyl)methylidene]amino]furan-2-carboxamide
CID 136915218

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-[amino(pyridin-2-yl)methylidene]amino]-2-hydroxybenzamide?
The IUPAC name of N-[(Z)-[amino(pyridin-2-yl)methylidene]amino]-2-hydroxybenzamide (CID 15777277) is N-[(Z)-[amino(pyridin-2-yl)methylidene]amino]-2-hydroxybenzamide.
What is the SMILES notation for N-[(Z)-[amino(pyridin-2-yl)methylidene]amino]-2-hydroxybenzamide?
The canonical SMILES for N-[(Z)-[amino(pyridin-2-yl)methylidene]amino]-2-hydroxybenzamide is N/C(=N\NC(=O)c1ccccc1O)c1ccccn1.
What is the InChIKey of N-[(Z)-[amino(pyridin-2-yl)methylidene]amino]-2-hydroxybenzamide?
The InChIKey is OXIXIKUEJFIPRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N4O2/c14-12(10-6-3-4-8-15-10)16-17-13(19)9-5-1-2-7-11(9)18/h1-8,18H,(H2,14,16)(H,17,19).
What are the key properties of N-[(Z)-[amino(pyridin-2-yl)methylidene]amino]-2-hydroxybenzamide?
N-[(Z)-[amino(pyridin-2-yl)methylidene]amino]-2-hydroxybenzamide has a molecular weight of 256.27 g/mol, XLogP of 0.84, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-[amino(pyridin-2-yl)methylidene]amino]-2-hydroxybenzamide is sourced from PubChem (CID 15777277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).