N-[(E)-(3-hydroxyphenyl)methylideneamino]pyridine-2-carboxamide

C13H11N3O2 — CID 6887460

IUPACN-[(E)-(3-hydroxyphenyl)methylideneamino]pyridine-2-carboxamide
SMILESO=C(N/N=C/c1cccc(O)c1)c1ccccn1
InChIInChI=1S/C13H11N3O2/c17-11-5-3-4-10(8-11)9-15-16-13(18)12-6-1-2-7-14-12/h1-9,17H,(H,16,18)/b15-9+
InChIKeyAIVSTDLJPLXUBC-OQLLNIDSSA-N
MW241.25 g/mol
LogP1.55
Rot. Bonds3

About N-[(E)-(3-hydroxyphenyl)methylideneamino]pyridine-2-carboxamide

N-[(E)-(3-hydroxyphenyl)methylideneamino]pyridine-2-carboxamide (PubChem CID 6887460) has the molecular formula C13H11N3O2 and a molecular weight of 241.25 g/mol. Its IUPAC name is N-[(E)-(3-hydroxyphenyl)methylideneamino]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[(E)-(3-hydroxyphenyl)methylideneamino]pyridine-2-carboxamide
PubChem CID6887460
Molecular FormulaC13H11N3O2
Molecular Weight241.25 g/mol
Exact Mass241.09
IUPAC NameN-[(E)-(3-hydroxyphenyl)methylideneamino]pyridine-2-carboxamide
SMILESO=C(N/N=C/c1cccc(O)c1)c1ccccn1
InChIInChI=1S/C13H11N3O2/c17-11-5-3-4-10(8-11)9-15-16-13(18)12-6-1-2-7-14-12/h1-9,17H,(H,16,18)/b15-9+
InChIKeyAIVSTDLJPLXUBC-OQLLNIDSSA-N
XLogP1.55
TPSA74.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.25
LogP ≤ 51.55
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

N-[(E)-(3-hydroxyphenyl)methylideneamino]pyrazine-2-carboxamide;hydrate
CID 139074065
N-[(3-methoxyphenyl)methylideneamino]pyridine-2-carboxamide
CID 761649
N-[(3-phenylmethoxyphenyl)methylideneamino]pyridine-2-carboxamide
CID 950938
N-[(Z)-(3-ethoxyphenyl)methylideneamino]pyridine-2-carboxamide
CID 40618803
N-[(E)-pyridin-3-ylmethylideneamino]pyridine-2-carboxamide
CID 6870358
N-[(Z)-[3-[(2-chlorophenyl)methoxy]phenyl]methylideneamino]pyridine-2-carboxamide
CID 9194640
N-[(E)-(3-fluoro-4-phenylphenyl)methylideneamino]pyridine-2-carboxamide
CID 44507539
N-[(3-chloro-4-methoxyphenyl)methylideneamino]pyridine-2-carboxamide
CID 871932
N-[(E)-(3-iodo-4-methoxyphenyl)methylideneamino]pyridine-2-carboxamide
CID 5335096
N-[(E)-(2,4-dichlorophenyl)methylideneamino]pyridine-2-carboxamide
CID 139068920
N-[(E)-[4-(trifluoromethyl)phenyl]methylideneamino]pyridine-2-carboxamide
CID 6879061
N-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]pyridine-2-carboxamide
CID 44507518

Frequently Asked Questions

What is the IUPAC name of N-[(E)-(3-hydroxyphenyl)methylideneamino]pyridine-2-carboxamide?
The IUPAC name of N-[(E)-(3-hydroxyphenyl)methylideneamino]pyridine-2-carboxamide (CID 6887460) is N-[(E)-(3-hydroxyphenyl)methylideneamino]pyridine-2-carboxamide.
What is the SMILES notation for N-[(E)-(3-hydroxyphenyl)methylideneamino]pyridine-2-carboxamide?
The canonical SMILES for N-[(E)-(3-hydroxyphenyl)methylideneamino]pyridine-2-carboxamide is O=C(N/N=C/c1cccc(O)c1)c1ccccn1.
What is the InChIKey of N-[(E)-(3-hydroxyphenyl)methylideneamino]pyridine-2-carboxamide?
The InChIKey is AIVSTDLJPLXUBC-OQLLNIDSSA-N. The full InChI is InChI=1S/C13H11N3O2/c17-11-5-3-4-10(8-11)9-15-16-13(18)12-6-1-2-7-14-12/h1-9,17H,(H,16,18)/b15-9+.
What are the key properties of N-[(E)-(3-hydroxyphenyl)methylideneamino]pyridine-2-carboxamide?
N-[(E)-(3-hydroxyphenyl)methylideneamino]pyridine-2-carboxamide has a molecular weight of 241.25 g/mol, XLogP of 1.55, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-(3-hydroxyphenyl)methylideneamino]pyridine-2-carboxamide is sourced from PubChem (CID 6887460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).