[3-(hydroxymethyliminomethyl)cyclopentyl]methanol

C8H15NO2 — CID 66595155

IUPAC[3-(hydroxymethyliminomethyl)cyclopentyl]methanol
SMILESOCN=CC1CCC(CO)C1
InChIInChI=1S/C8H15NO2/c10-5-8-2-1-7(3-8)4-9-6-11/h4,7-8,10-11H,1-3,5-6H2
InChIKeyASPYIACUCVGCNU-UHFFFAOYSA-N
MW157.21 g/mol
LogP0.42
Rot. Bonds3

About [3-(hydroxymethyliminomethyl)cyclopentyl]methanol

[3-(hydroxymethyliminomethyl)cyclopentyl]methanol (PubChem CID 66595155) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is [3-(hydroxymethyliminomethyl)cyclopentyl]methanol.

Molecular Properties

Compound Name[3-(hydroxymethyliminomethyl)cyclopentyl]methanol
PubChem CID66595155
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC Name[3-(hydroxymethyliminomethyl)cyclopentyl]methanol
SMILESOCN=CC1CCC(CO)C1
InChIInChI=1S/C8H15NO2/c10-5-8-2-1-7(3-8)4-9-6-11/h4,7-8,10-11H,1-3,5-6H2
InChIKeyASPYIACUCVGCNU-UHFFFAOYSA-N
XLogP0.42
TPSA52.82 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 50.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [3-(hydroxymethyliminomethyl)cyclopentyl]methanol?
The IUPAC name of [3-(hydroxymethyliminomethyl)cyclopentyl]methanol (CID 66595155) is [3-(hydroxymethyliminomethyl)cyclopentyl]methanol.
What is the SMILES notation for [3-(hydroxymethyliminomethyl)cyclopentyl]methanol?
The canonical SMILES for [3-(hydroxymethyliminomethyl)cyclopentyl]methanol is OCN=CC1CCC(CO)C1.
What is the InChIKey of [3-(hydroxymethyliminomethyl)cyclopentyl]methanol?
The InChIKey is ASPYIACUCVGCNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO2/c10-5-8-2-1-7(3-8)4-9-6-11/h4,7-8,10-11H,1-3,5-6H2.
What are the key properties of [3-(hydroxymethyliminomethyl)cyclopentyl]methanol?
[3-(hydroxymethyliminomethyl)cyclopentyl]methanol has a molecular weight of 157.21 g/mol, XLogP of 0.42, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(hydroxymethyliminomethyl)cyclopentyl]methanol is sourced from PubChem (CID 66595155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).