(Z)-piperidin-3-ylidenemethanol

C6H11NO — CID 20517397

IUPAC(Z)-piperidin-3-ylidenemethanol
SMILESO/C=C1/CCCNC1
InChIInChI=1S/C6H11NO/c8-5-6-2-1-3-7-4-6/h5,7-8H,1-4H2/b6-5-
InChIKeyGHWLSQVFZGWFLK-WAYWQWQTSA-N
MW113.16 g/mol
LogP0.81
Rot. Bonds

About (Z)-piperidin-3-ylidenemethanol

(Z)-piperidin-3-ylidenemethanol (PubChem CID 20517397) has the molecular formula C6H11NO and a molecular weight of 113.16 g/mol. Its IUPAC name is (Z)-piperidin-3-ylidenemethanol.

Molecular Properties

Compound Name(Z)-piperidin-3-ylidenemethanol
PubChem CID20517397
Molecular FormulaC6H11NO
Molecular Weight113.16 g/mol
Exact Mass113.08
IUPAC Name(Z)-piperidin-3-ylidenemethanol
SMILESO/C=C1/CCCNC1
InChIInChI=1S/C6H11NO/c8-5-6-2-1-3-7-4-6/h5,7-8H,1-4H2/b6-5-
InChIKeyGHWLSQVFZGWFLK-WAYWQWQTSA-N
XLogP0.81
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.16
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-piperidin-3-ylidenemethanol?
The IUPAC name of (Z)-piperidin-3-ylidenemethanol (CID 20517397) is (Z)-piperidin-3-ylidenemethanol.
What is the SMILES notation for (Z)-piperidin-3-ylidenemethanol?
The canonical SMILES for (Z)-piperidin-3-ylidenemethanol is O/C=C1/CCCNC1.
What is the InChIKey of (Z)-piperidin-3-ylidenemethanol?
The InChIKey is GHWLSQVFZGWFLK-WAYWQWQTSA-N. The full InChI is InChI=1S/C6H11NO/c8-5-6-2-1-3-7-4-6/h5,7-8H,1-4H2/b6-5-.
What are the key properties of (Z)-piperidin-3-ylidenemethanol?
(Z)-piperidin-3-ylidenemethanol has a molecular weight of 113.16 g/mol, XLogP of 0.81, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-piperidin-3-ylidenemethanol is sourced from PubChem (CID 20517397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).