N-[(2-hydroxy-5-iodophenyl)methylideneamino]pyridine-3-carboxamide

C13H10IN3O2 — CID 3600864

IUPACN-[(2-hydroxy-5-iodophenyl)methylideneamino]pyridine-3-carboxamide
SMILESO=C(NN=Cc1cc(I)ccc1O)c1cccnc1
InChIInChI=1S/C13H10IN3O2/c14-11-3-4-12(18)10(6-11)8-16-17-13(19)9-2-1-5-15-7-9/h1-8,18H,(H,17,19)
InChIKeyRHYPTDNBSDGKMO-UHFFFAOYSA-N
MW367.15 g/mol
LogP2.16
Rot. Bonds3

About N-[(2-hydroxy-5-iodophenyl)methylideneamino]pyridine-3-carboxamide

N-[(2-hydroxy-5-iodophenyl)methylideneamino]pyridine-3-carboxamide (PubChem CID 3600864) has the molecular formula C13H10IN3O2 and a molecular weight of 367.15 g/mol. Its IUPAC name is N-[(2-hydroxy-5-iodophenyl)methylideneamino]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(2-hydroxy-5-iodophenyl)methylideneamino]pyridine-3-carboxamide
PubChem CID3600864
Molecular FormulaC13H10IN3O2
Molecular Weight367.15 g/mol
Exact Mass366.98
IUPAC NameN-[(2-hydroxy-5-iodophenyl)methylideneamino]pyridine-3-carboxamide
SMILESO=C(NN=Cc1cc(I)ccc1O)c1cccnc1
InChIInChI=1S/C13H10IN3O2/c14-11-3-4-12(18)10(6-11)8-16-17-13(19)9-2-1-5-15-7-9/h1-8,18H,(H,17,19)
InChIKeyRHYPTDNBSDGKMO-UHFFFAOYSA-N
XLogP2.16
TPSA74.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.15
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[(E)-(5-bromo-2-hydroxyphenyl)methylideneamino]pyridine-3-carboxamide
CID 135428734
5-bromo-N-[(Z)-(2-hydroxy-5-iodophenyl)methylideneamino]pyridine-3-carboxamide
CID 136739125
4-fluoro-N-[(2-hydroxy-5-iodophenyl)methylideneamino]benzamide
CID 4220213
3-bromo-N-[(Z)-(2-hydroxy-5-iodophenyl)methylideneamino]benzamide
CID 135905942
N-[(E)-(3-bromo-4-hydroxyphenyl)methylideneamino]pyridine-3-carboxamide
CID 135591242
N-[[3-[(pyridine-3-carbonylhydrazinylidene)methyl]phenyl]methylideneamino]pyridine-3-carboxamide
CID 1379516
N-[[1-(4-iodophenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]pyridine-3-carboxamide
CID 2451315
N-[(E)-(2-hydroxy-4-methoxyphenyl)methylideneamino]pyridine-3-carboxamide;methanol
CID 139204410
N-[(E)-(3,5-dibromo-4-hydroxyphenyl)methylideneamino]pyridine-3-carboxamide
CID 135533190
N-(pyridin-2-ylmethylideneamino)pyridine-3-carboxamide
CID 577497
N-[(Z)-naphthalen-2-ylmethylideneamino]pyridine-3-carboxamide
CID 5399469
N-[(E)-(2-hydroxy-4-propoxyphenyl)methylideneamino]pyridine-3-carboxamide
CID 135591232

Frequently Asked Questions

What is the IUPAC name of N-[(2-hydroxy-5-iodophenyl)methylideneamino]pyridine-3-carboxamide?
The IUPAC name of N-[(2-hydroxy-5-iodophenyl)methylideneamino]pyridine-3-carboxamide (CID 3600864) is N-[(2-hydroxy-5-iodophenyl)methylideneamino]pyridine-3-carboxamide.
What is the SMILES notation for N-[(2-hydroxy-5-iodophenyl)methylideneamino]pyridine-3-carboxamide?
The canonical SMILES for N-[(2-hydroxy-5-iodophenyl)methylideneamino]pyridine-3-carboxamide is O=C(NN=Cc1cc(I)ccc1O)c1cccnc1.
What is the InChIKey of N-[(2-hydroxy-5-iodophenyl)methylideneamino]pyridine-3-carboxamide?
The InChIKey is RHYPTDNBSDGKMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10IN3O2/c14-11-3-4-12(18)10(6-11)8-16-17-13(19)9-2-1-5-15-7-9/h1-8,18H,(H,17,19).
What are the key properties of N-[(2-hydroxy-5-iodophenyl)methylideneamino]pyridine-3-carboxamide?
N-[(2-hydroxy-5-iodophenyl)methylideneamino]pyridine-3-carboxamide has a molecular weight of 367.15 g/mol, XLogP of 2.16, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-hydroxy-5-iodophenyl)methylideneamino]pyridine-3-carboxamide is sourced from PubChem (CID 3600864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).