[1-(azetidin-1-ylmethyl)cyclopropyl]methyl hypoiodite

C8H14INO — CID 177000527

IUPAC[1-(azetidin-1-ylmethyl)cyclopropyl]methyl hypoiodite
SMILESIOCC1(CN2CCC2)CC1
InChIInChI=1S/C8H14INO/c9-11-7-8(2-3-8)6-10-4-1-5-10/h1-7H2
InChIKeyZMYGHQMZVQASDK-UHFFFAOYSA-N
MW267.11 g/mol
LogP1.84
Rot. Bonds4

About [1-(azetidin-1-ylmethyl)cyclopropyl]methyl hypoiodite

[1-(azetidin-1-ylmethyl)cyclopropyl]methyl hypoiodite (PubChem CID 177000527) has the molecular formula C8H14INO and a molecular weight of 267.11 g/mol. Its IUPAC name is [1-(azetidin-1-ylmethyl)cyclopropyl]methyl hypoiodite.

Molecular Properties

Compound Name[1-(azetidin-1-ylmethyl)cyclopropyl]methyl hypoiodite
PubChem CID177000527
Molecular FormulaC8H14INO
Molecular Weight267.11 g/mol
Exact Mass267.01
IUPAC Name[1-(azetidin-1-ylmethyl)cyclopropyl]methyl hypoiodite
SMILESIOCC1(CN2CCC2)CC1
InChIInChI=1S/C8H14INO/c9-11-7-8(2-3-8)6-10-4-1-5-10/h1-7H2
InChIKeyZMYGHQMZVQASDK-UHFFFAOYSA-N
XLogP1.84
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.11
LogP ≤ 51.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze [1-(azetidin-1-ylmethyl)cyclopropyl]methyl hypoiodite 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

[1-(Azetidin-1-ylmethyl)cyclopropyl]methyl hypofluorite
CID 166533231
(1-(Azetidin-1-ylmethyl)cyclopropyl)methanol
CID 129049503
1-[[1-(Methoxymethyl)cyclopropyl]methyl]azetidine
CID 147865054
Potassium [1-(azetidin-1-ylmethyl)cyclopropyl]methanolate
CID 164878670
Ethane;1-[[1-(methoxymethyl)cyclopropyl]methyl]azetidine
CID 164878995
3-Ethyl-1-[[1-(methoxymethyl)cyclopropyl]methyl]azetidine
CID 169228979
[1-[[Methyl(propyl)amino]methyl]cyclopropyl]methyl hypoiodite
CID 170083103
Ethane;1-[[1-(methoxymethyl)cyclopropyl]methyl]-3,3-dimethylazetidine
CID 172348552
1-[[1-(Ethoxymethyl)cyclopropyl]methyl]azetidine
CID 172348842
Ethane;1-[[1-(methoxymethyl)cyclopropyl]methyl]azetidine
CID 172350316
[1-[[Ethyl(propyl)amino]methyl]cyclopropyl]methyl hypoiodite
CID 172367068
3-(5-Azaspiro[2.3]hexan-5-yl)propan-1-ol
CID 104549003

Frequently Asked Questions

What is the IUPAC name of [1-(azetidin-1-ylmethyl)cyclopropyl]methyl hypoiodite?
The IUPAC name of [1-(azetidin-1-ylmethyl)cyclopropyl]methyl hypoiodite (CID 177000527) is [1-(azetidin-1-ylmethyl)cyclopropyl]methyl hypoiodite.
What is the SMILES notation for [1-(azetidin-1-ylmethyl)cyclopropyl]methyl hypoiodite?
The canonical SMILES for [1-(azetidin-1-ylmethyl)cyclopropyl]methyl hypoiodite is IOCC1(CN2CCC2)CC1.
What is the InChIKey of [1-(azetidin-1-ylmethyl)cyclopropyl]methyl hypoiodite?
The InChIKey is ZMYGHQMZVQASDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14INO/c9-11-7-8(2-3-8)6-10-4-1-5-10/h1-7H2.
What are the key properties of [1-(azetidin-1-ylmethyl)cyclopropyl]methyl hypoiodite?
[1-(azetidin-1-ylmethyl)cyclopropyl]methyl hypoiodite has a molecular weight of 267.11 g/mol, XLogP of 1.84, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(azetidin-1-ylmethyl)cyclopropyl]methyl hypoiodite is sourced from PubChem (CID 177000527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).