[1-(iodoamino)cyclopropyl]methanol

C4H8INO — CID 87696241

IUPAC[1-(iodoamino)cyclopropyl]methanol
SMILESOCC1(NI)CC1
InChIInChI=1S/C4H8INO/c5-6-4(3-7)1-2-4/h6-7H,1-3H2
InChIKeyCXFZHXOZZCVEKE-UHFFFAOYSA-N
MW213.02 g/mol
LogP0.45
Rot. Bonds2

About [1-(iodoamino)cyclopropyl]methanol

[1-(iodoamino)cyclopropyl]methanol (PubChem CID 87696241) has the molecular formula C4H8INO and a molecular weight of 213.02 g/mol. Its IUPAC name is [1-(iodoamino)cyclopropyl]methanol.

Molecular Properties

Compound Name[1-(iodoamino)cyclopropyl]methanol
PubChem CID87696241
Molecular FormulaC4H8INO
Molecular Weight213.02 g/mol
Exact Mass212.97
IUPAC Name[1-(iodoamino)cyclopropyl]methanol
SMILESOCC1(NI)CC1
InChIInChI=1S/C4H8INO/c5-6-4(3-7)1-2-4/h6-7H,1-3H2
InChIKeyCXFZHXOZZCVEKE-UHFFFAOYSA-N
XLogP0.45
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.02
LogP ≤ 50.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(1-Aminocyclopropyl)methanol
CID 14146220
(1-Aminocyclopropyl)methanol hydrochloride
CID 14146222
(1-Aminocyclopropyl)methanediol
CID 68274770
(1-Aminocyclopropyl)methyl hypoiodite
CID 132240276
(1-Aminocyclopropyl)methyloxidanium
CID 142376738
2-(Iodoamino)-2-methylpropan-1-ol
CID 143125084
[1-(Chloroamino)cyclopropyl]methanol
CID 146469638
[1-(Sulfanylamino)cyclopropyl]methanol
CID 164045820
CID 164104616
CID 164104616
Potassium [1-(hydroxymethyl)cyclopropyl]azanide
CID 177976760
[1-(Hydroxymethyl)cyclopropyl]azanium
CID 40153952
2-Amino-2-methylcyclopropan-1-ol
CID 118162339

Frequently Asked Questions

What is the IUPAC name of [1-(iodoamino)cyclopropyl]methanol?
The IUPAC name of [1-(iodoamino)cyclopropyl]methanol (CID 87696241) is [1-(iodoamino)cyclopropyl]methanol.
What is the SMILES notation for [1-(iodoamino)cyclopropyl]methanol?
The canonical SMILES for [1-(iodoamino)cyclopropyl]methanol is OCC1(NI)CC1.
What is the InChIKey of [1-(iodoamino)cyclopropyl]methanol?
The InChIKey is CXFZHXOZZCVEKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8INO/c5-6-4(3-7)1-2-4/h6-7H,1-3H2.
What are the key properties of [1-(iodoamino)cyclopropyl]methanol?
[1-(iodoamino)cyclopropyl]methanol has a molecular weight of 213.02 g/mol, XLogP of 0.45, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(iodoamino)cyclopropyl]methanol is sourced from PubChem (CID 87696241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).