4-(2-methoxyiminocyclopentyl)butan-1-ol

C10H19NO2 — CID 85157202

IUPAC4-(2-methoxyiminocyclopentyl)butan-1-ol
SMILESCON=C1CCCC1CCCCO
InChIInChI=1S/C10H19NO2/c1-13-11-10-7-4-6-9(10)5-2-3-8-12/h9,12H,2-8H2,1H3
InChIKeyOWVKWVBKGXYAOV-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.95
Rot. Bonds5

About 4-(2-methoxyiminocyclopentyl)butan-1-ol

4-(2-methoxyiminocyclopentyl)butan-1-ol (PubChem CID 85157202) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is 4-(2-methoxyiminocyclopentyl)butan-1-ol.

Molecular Properties

Compound Name4-(2-methoxyiminocyclopentyl)butan-1-ol
PubChem CID85157202
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name4-(2-methoxyiminocyclopentyl)butan-1-ol
SMILESCON=C1CCCC1CCCCO
InChIInChI=1S/C10H19NO2/c1-13-11-10-7-4-6-9(10)5-2-3-8-12/h9,12H,2-8H2,1H3
InChIKeyOWVKWVBKGXYAOV-UHFFFAOYSA-N
XLogP1.95
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxyiminocyclopentyl)butan-1-ol?
The IUPAC name of 4-(2-methoxyiminocyclopentyl)butan-1-ol (CID 85157202) is 4-(2-methoxyiminocyclopentyl)butan-1-ol.
What is the SMILES notation for 4-(2-methoxyiminocyclopentyl)butan-1-ol?
The canonical SMILES for 4-(2-methoxyiminocyclopentyl)butan-1-ol is CON=C1CCCC1CCCCO.
What is the InChIKey of 4-(2-methoxyiminocyclopentyl)butan-1-ol?
The InChIKey is OWVKWVBKGXYAOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-13-11-10-7-4-6-9(10)5-2-3-8-12/h9,12H,2-8H2,1H3.
What are the key properties of 4-(2-methoxyiminocyclopentyl)butan-1-ol?
4-(2-methoxyiminocyclopentyl)butan-1-ol has a molecular weight of 185.27 g/mol, XLogP of 1.95, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyiminocyclopentyl)butan-1-ol is sourced from PubChem (CID 85157202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).