(Z)-2-methyl-3-piperidin-4-ylprop-2-en-1-ol

C9H17NO — CID 142325174

IUPAC(Z)-2-methyl-3-piperidin-4-ylprop-2-en-1-ol
SMILESC/C(=C/C1CCNCC1)CO
InChIInChI=1S/C9H17NO/c1-8(7-11)6-9-2-4-10-5-3-9/h6,9-11H,2-5,7H2,1H3/b8-6-
InChIKeyKXBYKHMIYJKHBN-VURMDHGXSA-N
MW155.24 g/mol
LogP0.92
Rot. Bonds2

About (Z)-2-methyl-3-piperidin-4-ylprop-2-en-1-ol

(Z)-2-methyl-3-piperidin-4-ylprop-2-en-1-ol (PubChem CID 142325174) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is (Z)-2-methyl-3-piperidin-4-ylprop-2-en-1-ol.

Molecular Properties

Compound Name(Z)-2-methyl-3-piperidin-4-ylprop-2-en-1-ol
PubChem CID142325174
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name(Z)-2-methyl-3-piperidin-4-ylprop-2-en-1-ol
SMILESC/C(=C/C1CCNCC1)CO
InChIInChI=1S/C9H17NO/c1-8(7-11)6-9-2-4-10-5-3-9/h6,9-11H,2-5,7H2,1H3/b8-6-
InChIKeyKXBYKHMIYJKHBN-VURMDHGXSA-N
XLogP0.92
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-2-methyl-3-piperidin-4-ylprop-2-en-1-ol?
The IUPAC name of (Z)-2-methyl-3-piperidin-4-ylprop-2-en-1-ol (CID 142325174) is (Z)-2-methyl-3-piperidin-4-ylprop-2-en-1-ol.
What is the SMILES notation for (Z)-2-methyl-3-piperidin-4-ylprop-2-en-1-ol?
The canonical SMILES for (Z)-2-methyl-3-piperidin-4-ylprop-2-en-1-ol is C/C(=C/C1CCNCC1)CO.
What is the InChIKey of (Z)-2-methyl-3-piperidin-4-ylprop-2-en-1-ol?
The InChIKey is KXBYKHMIYJKHBN-VURMDHGXSA-N. The full InChI is InChI=1S/C9H17NO/c1-8(7-11)6-9-2-4-10-5-3-9/h6,9-11H,2-5,7H2,1H3/b8-6-.
What are the key properties of (Z)-2-methyl-3-piperidin-4-ylprop-2-en-1-ol?
(Z)-2-methyl-3-piperidin-4-ylprop-2-en-1-ol has a molecular weight of 155.24 g/mol, XLogP of 0.92, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-methyl-3-piperidin-4-ylprop-2-en-1-ol is sourced from PubChem (CID 142325174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).