[(Z)-3-aminobut-2-en-2-yl] hypoiodite

C4H8INO — CID 163947046

IUPAC[(Z)-3-aminobut-2-en-2-yl] hypoiodite
SMILESC/C(N)=C(\C)OI
InChIInChI=1S/C4H8INO/c1-3(6)4(2)7-5/h6H2,1-2H3/b4-3-
InChIKeyRWACWSPRXOMHBH-ARJAWSKDSA-N
MW213.02 g/mol
LogP1.56
Rot. Bonds1

About [(Z)-3-aminobut-2-en-2-yl] hypoiodite

[(Z)-3-aminobut-2-en-2-yl] hypoiodite (PubChem CID 163947046) has the molecular formula C4H8INO and a molecular weight of 213.02 g/mol. Its IUPAC name is [(Z)-3-aminobut-2-en-2-yl] hypoiodite.

Molecular Properties

Compound Name[(Z)-3-aminobut-2-en-2-yl] hypoiodite
PubChem CID163947046
Molecular FormulaC4H8INO
Molecular Weight213.02 g/mol
Exact Mass212.97
IUPAC Name[(Z)-3-aminobut-2-en-2-yl] hypoiodite
SMILESC/C(N)=C(\C)OI
InChIInChI=1S/C4H8INO/c1-3(6)4(2)7-5/h6H2,1-2H3/b4-3-
InChIKeyRWACWSPRXOMHBH-ARJAWSKDSA-N
XLogP1.56
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.02
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

(Z)-3-aminobut-2-en-2-ol
CID 57634793
2-Amino-3-hydroxy-2-butene
CID 76571458
(Z)-3-methoxybut-2-en-2-amine
CID 130248747
O-[(Z)-3-aminobut-2-en-2-yl]hydroxylamine
CID 142004467
O-[(Z)-3-aminobut-2-en-2-yl]hydroxylamine;ethane
CID 176658687

Frequently Asked Questions

What is the IUPAC name of [(Z)-3-aminobut-2-en-2-yl] hypoiodite?
The IUPAC name of [(Z)-3-aminobut-2-en-2-yl] hypoiodite (CID 163947046) is [(Z)-3-aminobut-2-en-2-yl] hypoiodite.
What is the SMILES notation for [(Z)-3-aminobut-2-en-2-yl] hypoiodite?
The canonical SMILES for [(Z)-3-aminobut-2-en-2-yl] hypoiodite is C/C(N)=C(\C)OI.
What is the InChIKey of [(Z)-3-aminobut-2-en-2-yl] hypoiodite?
The InChIKey is RWACWSPRXOMHBH-ARJAWSKDSA-N. The full InChI is InChI=1S/C4H8INO/c1-3(6)4(2)7-5/h6H2,1-2H3/b4-3-.
What are the key properties of [(Z)-3-aminobut-2-en-2-yl] hypoiodite?
[(Z)-3-aminobut-2-en-2-yl] hypoiodite has a molecular weight of 213.02 g/mol, XLogP of 1.56, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-3-aminobut-2-en-2-yl] hypoiodite is sourced from PubChem (CID 163947046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).