4-hydroxy-N-[(E)-(2-iodophenyl)methylideneamino]benzamide

C14H11IN2O2 — CID 6906211

IUPAC4-hydroxy-N-[(E)-(2-iodophenyl)methylideneamino]benzamide
SMILESO=C(N/N=C/c1ccccc1I)c1ccc(O)cc1
InChIInChI=1S/C14H11IN2O2/c15-13-4-2-1-3-11(13)9-16-17-14(19)10-5-7-12(18)8-6-10/h1-9,18H,(H,17,19)/b16-9+
InChIKeyXSGFPTNWXPXNFT-CXUHLZMHSA-N
MW366.16 g/mol
LogP2.76
Rot. Bonds3

About 4-hydroxy-N-[(E)-(2-iodophenyl)methylideneamino]benzamide

4-hydroxy-N-[(E)-(2-iodophenyl)methylideneamino]benzamide (PubChem CID 6906211) has the molecular formula C14H11IN2O2 and a molecular weight of 366.16 g/mol. Its IUPAC name is 4-hydroxy-N-[(E)-(2-iodophenyl)methylideneamino]benzamide.

Molecular Properties

Compound Name4-hydroxy-N-[(E)-(2-iodophenyl)methylideneamino]benzamide
PubChem CID6906211
Molecular FormulaC14H11IN2O2
Molecular Weight366.16 g/mol
Exact Mass365.99
IUPAC Name4-hydroxy-N-[(E)-(2-iodophenyl)methylideneamino]benzamide
SMILESO=C(N/N=C/c1ccccc1I)c1ccc(O)cc1
InChIInChI=1S/C14H11IN2O2/c15-13-4-2-1-3-11(13)9-16-17-14(19)10-5-7-12(18)8-6-10/h1-9,18H,(H,17,19)/b16-9+
InChIKeyXSGFPTNWXPXNFT-CXUHLZMHSA-N
XLogP2.76
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.16
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'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

4-hydroxy-N-[(Z)-naphthalen-1-ylmethylideneamino]benzamide
CID 5406601
3-bromo-N-[(2-iodophenyl)methylideneamino]benzamide
CID 3586825
4-hydroxy-N-[(Z)-(2-hydroxy-3,5-diiodophenyl)methylideneamino]benzamide
CID 135894860
4-hydroxy-N-[(E)-(4-hydroxynaphthalen-1-yl)methylideneamino]benzamide
CID 135542439
4-hydroxy-N-[(2-propoxyphenyl)methylideneamino]benzamide
CID 4300474
2-[2-[[(4-hydroxybenzoyl)hydrazinylidene]methyl]phenoxy]acetic acid
CID 684020
N-[(E)-(2-iodophenyl)methylideneamino]thiophene-2-carboxamide
CID 6910346
2-[2-[[(4-hydroxybenzoyl)hydrazinylidene]methyl]phenoxy]acetate
CID 2306178
N-[(E)-(2-butoxyphenyl)methylideneamino]-4-hydroxybenzamide
CID 110338477
N-[(2-hydroxyphenyl)methylideneamino]-4-phenylbenzamide
CID 827697
[4-[[(4-hydroxybenzoyl)hydrazinylidene]methyl]phenyl] 2-iodobenzoate
CID 3415609
N'-[(E)-(2-iodophenyl)methylideneamino]oxamide
CID 6910277

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-[(E)-(2-iodophenyl)methylideneamino]benzamide?
The IUPAC name of 4-hydroxy-N-[(E)-(2-iodophenyl)methylideneamino]benzamide (CID 6906211) is 4-hydroxy-N-[(E)-(2-iodophenyl)methylideneamino]benzamide.
What is the SMILES notation for 4-hydroxy-N-[(E)-(2-iodophenyl)methylideneamino]benzamide?
The canonical SMILES for 4-hydroxy-N-[(E)-(2-iodophenyl)methylideneamino]benzamide is O=C(N/N=C/c1ccccc1I)c1ccc(O)cc1.
What is the InChIKey of 4-hydroxy-N-[(E)-(2-iodophenyl)methylideneamino]benzamide?
The InChIKey is XSGFPTNWXPXNFT-CXUHLZMHSA-N. The full InChI is InChI=1S/C14H11IN2O2/c15-13-4-2-1-3-11(13)9-16-17-14(19)10-5-7-12(18)8-6-10/h1-9,18H,(H,17,19)/b16-9+.
What are the key properties of 4-hydroxy-N-[(E)-(2-iodophenyl)methylideneamino]benzamide?
4-hydroxy-N-[(E)-(2-iodophenyl)methylideneamino]benzamide has a molecular weight of 366.16 g/mol, XLogP of 2.76, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-[(E)-(2-iodophenyl)methylideneamino]benzamide is sourced from PubChem (CID 6906211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).