2-(2-iodoanilino)ethanol

C8H10INO — CID 28978311

IUPAC2-(2-iodoanilino)ethanol
SMILESOCCNc1ccccc1I
InChIInChI=1S/C8H10INO/c9-7-3-1-2-4-8(7)10-5-6-11/h1-4,10-11H,5-6H2
InChIKeyFVPSYVGJBHOITC-UHFFFAOYSA-N
MW263.08 g/mol
LogP1.70
Rot. Bonds3

About 2-(2-iodoanilino)ethanol

2-(2-iodoanilino)ethanol (PubChem CID 28978311) has the molecular formula C8H10INO and a molecular weight of 263.08 g/mol. Its IUPAC name is 2-(2-iodoanilino)ethanol.

Molecular Properties

Compound Name2-(2-iodoanilino)ethanol
PubChem CID28978311
Molecular FormulaC8H10INO
Molecular Weight263.08 g/mol
Exact Mass262.98
IUPAC Name2-(2-iodoanilino)ethanol
SMILESOCCNc1ccccc1I
InChIInChI=1S/C8H10INO/c9-7-3-1-2-4-8(7)10-5-6-11/h1-4,10-11H,5-6H2
InChIKeyFVPSYVGJBHOITC-UHFFFAOYSA-N
XLogP1.70
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.08
LogP ≤ 51.70
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

4-(2-iodoanilino)butan-2-one
CID 71353813
3-(2-iodoanilino)propanenitrile
CID 43082717
4-(2-iodoanilino)butanenitrile
CID 28876808
2-iodo-N-(2-methylsulfonylethyl)aniline
CID 60917001
4-(2-iodoanilino)-N-methylbutanamide
CID 63891619
3-(2-hydroxyethylamino)benzene-1,2-diol
CID 70502073
2-(2-hydroxyethylamino)benzenesulfonic acid
CID 20512895
2-(2-propan-2-ylanilino)ethanol
CID 28574084
ethyl 3-(2-iodoanilino)propanoate
CID 43174220
N-(3-ethoxypropyl)-2-iodoaniline
CID 65175161
1-(2-iodoanilino)-3-methylbutan-2-ol
CID 126975335
[2-(2-hydroxyethylamino)phenoxy]boronic acid
CID 150690493

Frequently Asked Questions

What is the IUPAC name of 2-(2-iodoanilino)ethanol?
The IUPAC name of 2-(2-iodoanilino)ethanol (CID 28978311) is 2-(2-iodoanilino)ethanol.
What is the SMILES notation for 2-(2-iodoanilino)ethanol?
The canonical SMILES for 2-(2-iodoanilino)ethanol is OCCNc1ccccc1I.
What is the InChIKey of 2-(2-iodoanilino)ethanol?
The InChIKey is FVPSYVGJBHOITC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10INO/c9-7-3-1-2-4-8(7)10-5-6-11/h1-4,10-11H,5-6H2.
What are the key properties of 2-(2-iodoanilino)ethanol?
2-(2-iodoanilino)ethanol has a molecular weight of 263.08 g/mol, XLogP of 1.70, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-iodoanilino)ethanol is sourced from PubChem (CID 28978311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).