3-iminocyclopentan-1-ol

C5H9NO — CID 57278866

IUPAC3-iminocyclopentan-1-ol
SMILES[H]/N=C1\CCC(O)C1
InChIInChI=1S/C5H9NO/c6-4-1-2-5(7)3-4/h5-7H,1-3H2/b6-4+
InChIKeyWYLMANOXOUPLHS-GQCTYLIASA-N
MW99.13 g/mol
LogP0.55
Rot. Bonds

About 3-iminocyclopentan-1-ol

3-iminocyclopentan-1-ol (PubChem CID 57278866) has the molecular formula C5H9NO and a molecular weight of 99.13 g/mol. Its IUPAC name is 3-iminocyclopentan-1-ol.

Molecular Properties

Compound Name3-iminocyclopentan-1-ol
PubChem CID57278866
Molecular FormulaC5H9NO
Molecular Weight99.13 g/mol
Exact Mass99.07
IUPAC Name3-iminocyclopentan-1-ol
SMILES[H]/N=C1\CCC(O)C1
InChIInChI=1S/C5H9NO/c6-4-1-2-5(7)3-4/h5-7H,1-3H2/b6-4+
InChIKeyWYLMANOXOUPLHS-GQCTYLIASA-N
XLogP0.55
TPSA44.08 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50099.13
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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-iminocyclopentan-1-ol?
The IUPAC name of 3-iminocyclopentan-1-ol (CID 57278866) is 3-iminocyclopentan-1-ol.
What is the SMILES notation for 3-iminocyclopentan-1-ol?
The canonical SMILES for 3-iminocyclopentan-1-ol is [H]/N=C1\CCC(O)C1.
What is the InChIKey of 3-iminocyclopentan-1-ol?
The InChIKey is WYLMANOXOUPLHS-GQCTYLIASA-N. The full InChI is InChI=1S/C5H9NO/c6-4-1-2-5(7)3-4/h5-7H,1-3H2/b6-4+.
What are the key properties of 3-iminocyclopentan-1-ol?
3-iminocyclopentan-1-ol has a molecular weight of 99.13 g/mol, XLogP of 0.55, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-iminocyclopentan-1-ol is sourced from PubChem (CID 57278866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).