2-hydroxy-5-iodo-N-(2-propylphenyl)benzamide

C16H16INO2 — CID 107731680

IUPAC2-hydroxy-5-iodo-N-(2-propylphenyl)benzamide
SMILESCCCc1ccccc1NC(=O)c1cc(I)ccc1O
InChIInChI=1S/C16H16INO2/c1-2-5-11-6-3-4-7-14(11)18-16(20)13-10-12(17)8-9-15(13)19/h3-4,6-10,19H,2,5H2,1H3,(H,18,20)
InChIKeyWBSHBBUWKIOYOF-UHFFFAOYSA-N
MW381.21 g/mol
LogP4.20
Rot. Bonds4

About 2-hydroxy-5-iodo-N-(2-propylphenyl)benzamide

2-hydroxy-5-iodo-N-(2-propylphenyl)benzamide (PubChem CID 107731680) has the molecular formula C16H16INO2 and a molecular weight of 381.21 g/mol. Its IUPAC name is 2-hydroxy-5-iodo-N-(2-propylphenyl)benzamide.

Molecular Properties

Compound Name2-hydroxy-5-iodo-N-(2-propylphenyl)benzamide
PubChem CID107731680
Molecular FormulaC16H16INO2
Molecular Weight381.21 g/mol
Exact Mass381.02
IUPAC Name2-hydroxy-5-iodo-N-(2-propylphenyl)benzamide
SMILESCCCc1ccccc1NC(=O)c1cc(I)ccc1O
InChIInChI=1S/C16H16INO2/c1-2-5-11-6-3-4-7-14(11)18-16(20)13-10-12(17)8-9-15(13)19/h3-4,6-10,19H,2,5H2,1H3,(H,18,20)
InChIKeyWBSHBBUWKIOYOF-UHFFFAOYSA-N
XLogP4.20
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.21
LogP ≤ 54.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-hydroxy-N-(2-pentylphenyl)benzamide
CID 90027377
4-hydroxy-3-methyl-N-(2-propylphenyl)benzamide
CID 103956497
N-(2-ethylphenyl)-5-fluoro-2-hydroxybenzamide
CID 115298874
2-hydroxy-N-[2-(hydroxymethyl)phenyl]-5-methylbenzamide
CID 61498041
2-[2-[(2-hydroxy-5-methylbenzoyl)amino]phenyl]acetic acid
CID 62535909
2-hydroxy-5-iodo-N-(4-iodo-2-methylphenyl)benzamide
CID 86251688
4-fluoro-2-methyl-N-(2-propylphenyl)benzamide
CID 115745651
5-methyl-2-(methylamino)-N-(2-propylphenyl)benzamide
CID 62509909
2-fluoro-4-methyl-N-(2-propylphenyl)benzamide
CID 79778827
ethane;N-(2-propylphenyl)acetamide
CID 142804217
5-heptyl-N-[2-[(5-heptyl-2-hydroxybenzoyl)amino]phenyl]-2-hydroxybenzamide
CID 101305952
N-[3-(ethylaminomethyl)phenyl]-2-hydroxy-5-iodobenzamide
CID 107732035

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-5-iodo-N-(2-propylphenyl)benzamide?
The IUPAC name of 2-hydroxy-5-iodo-N-(2-propylphenyl)benzamide (CID 107731680) is 2-hydroxy-5-iodo-N-(2-propylphenyl)benzamide.
What is the SMILES notation for 2-hydroxy-5-iodo-N-(2-propylphenyl)benzamide?
The canonical SMILES for 2-hydroxy-5-iodo-N-(2-propylphenyl)benzamide is CCCc1ccccc1NC(=O)c1cc(I)ccc1O.
What is the InChIKey of 2-hydroxy-5-iodo-N-(2-propylphenyl)benzamide?
The InChIKey is WBSHBBUWKIOYOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16INO2/c1-2-5-11-6-3-4-7-14(11)18-16(20)13-10-12(17)8-9-15(13)19/h3-4,6-10,19H,2,5H2,1H3,(H,18,20).
What are the key properties of 2-hydroxy-5-iodo-N-(2-propylphenyl)benzamide?
2-hydroxy-5-iodo-N-(2-propylphenyl)benzamide has a molecular weight of 381.21 g/mol, XLogP of 4.20, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-5-iodo-N-(2-propylphenyl)benzamide is sourced from PubChem (CID 107731680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).