2-hydroxy-4-iodo-N-methoxy-N-methylbenzamide

C9H10INO3 — CID 135067027

IUPAC2-hydroxy-4-iodo-N-methoxy-N-methylbenzamide
SMILESCON(C)C(=O)c1ccc(I)cc1O
InChIInChI=1S/C9H10INO3/c1-11(14-2)9(13)7-4-3-6(10)5-8(7)12/h3-5,12H,1-2H3
InChIKeyFCEGIAJJKSNROU-UHFFFAOYSA-N
MW307.09 g/mol
LogP1.63
Rot. Bonds2

About 2-hydroxy-4-iodo-N-methoxy-N-methylbenzamide

2-hydroxy-4-iodo-N-methoxy-N-methylbenzamide (PubChem CID 135067027) has the molecular formula C9H10INO3 and a molecular weight of 307.09 g/mol. Its IUPAC name is 2-hydroxy-4-iodo-N-methoxy-N-methylbenzamide.

Molecular Properties

Compound Name2-hydroxy-4-iodo-N-methoxy-N-methylbenzamide
PubChem CID135067027
Molecular FormulaC9H10INO3
Molecular Weight307.09 g/mol
Exact Mass306.97
IUPAC Name2-hydroxy-4-iodo-N-methoxy-N-methylbenzamide
SMILESCON(C)C(=O)c1ccc(I)cc1O
InChIInChI=1S/C9H10INO3/c1-11(14-2)9(13)7-4-3-6(10)5-8(7)12/h3-5,12H,1-2H3
InChIKeyFCEGIAJJKSNROU-UHFFFAOYSA-N
XLogP1.63
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.09
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-hydroxy-4-iodo-N-methoxy-N-methylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,3-dihydroxy-N-methoxy-N-methylbenzamide
CID 114344880
argon;methyl 2-hydroxy-4-iodobenzoate
CID 159067231
2-hydroxybenzoic acid;2-hydroxy-N-methoxy-N-methylbenzamide
CID 158439697
1-N,4-N-dimethoxy-1-N,4-N-dimethylnaphthalene-1,4-dicarboxamide
CID 71406304
2-amino-4-fluoro-N-methoxy-N-methylbenzamide
CID 63110530
3-amino-2-hydroxy-N-methoxy-N-methylbenzamide
CID 58735961
2-hydroxy-N-methoxy-N-methyl-4-(oxan-2-yloxy)benzamide
CID 129079902
4-iodo-N-methoxy-N-methylthiophene-2-carboxamide
CID 156842877
5-fluoro-N-methoxy-N,2,4-trimethylbenzamide
CID 89047148
ethane;2-hydroxy-4-methoxy-N,N-dimethylbenzamide
CID 144990982
4-bromo-2,3-difluoro-N-methoxy-N-methylbenzamide
CID 171366673
2-bromo-N,4,5-trimethoxy-N-methylbenzamide
CID 90127344

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-4-iodo-N-methoxy-N-methylbenzamide?
The IUPAC name of 2-hydroxy-4-iodo-N-methoxy-N-methylbenzamide (CID 135067027) is 2-hydroxy-4-iodo-N-methoxy-N-methylbenzamide.
What is the SMILES notation for 2-hydroxy-4-iodo-N-methoxy-N-methylbenzamide?
The canonical SMILES for 2-hydroxy-4-iodo-N-methoxy-N-methylbenzamide is CON(C)C(=O)c1ccc(I)cc1O.
What is the InChIKey of 2-hydroxy-4-iodo-N-methoxy-N-methylbenzamide?
The InChIKey is FCEGIAJJKSNROU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10INO3/c1-11(14-2)9(13)7-4-3-6(10)5-8(7)12/h3-5,12H,1-2H3.
What are the key properties of 2-hydroxy-4-iodo-N-methoxy-N-methylbenzamide?
2-hydroxy-4-iodo-N-methoxy-N-methylbenzamide has a molecular weight of 307.09 g/mol, XLogP of 1.63, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-4-iodo-N-methoxy-N-methylbenzamide is sourced from PubChem (CID 135067027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).