4-(2-methylprop-2-enyl)piperidin-4-ol

C9H17NO — CID 123241473

IUPAC4-(2-methylprop-2-enyl)piperidin-4-ol
SMILESC=C(C)CC1(O)CCNCC1
InChIInChI=1S/C9H17NO/c1-8(2)7-9(11)3-5-10-6-4-9/h10-11H,1,3-7H2,2H3
InChIKeyVBKKVCAEESABGV-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.07
Rot. Bonds2

About 4-(2-methylprop-2-enyl)piperidin-4-ol

4-(2-methylprop-2-enyl)piperidin-4-ol (PubChem CID 123241473) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is 4-(2-methylprop-2-enyl)piperidin-4-ol.

Molecular Properties

Compound Name4-(2-methylprop-2-enyl)piperidin-4-ol
PubChem CID123241473
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name4-(2-methylprop-2-enyl)piperidin-4-ol
SMILESC=C(C)CC1(O)CCNCC1
InChIInChI=1S/C9H17NO/c1-8(2)7-9(11)3-5-10-6-4-9/h10-11H,1,3-7H2,2H3
InChIKeyVBKKVCAEESABGV-UHFFFAOYSA-N
XLogP1.07
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 ≤ 51.07
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 4-(2-methylprop-2-enyl)piperidin-4-ol?
The IUPAC name of 4-(2-methylprop-2-enyl)piperidin-4-ol (CID 123241473) is 4-(2-methylprop-2-enyl)piperidin-4-ol.
What is the SMILES notation for 4-(2-methylprop-2-enyl)piperidin-4-ol?
The canonical SMILES for 4-(2-methylprop-2-enyl)piperidin-4-ol is C=C(C)CC1(O)CCNCC1.
What is the InChIKey of 4-(2-methylprop-2-enyl)piperidin-4-ol?
The InChIKey is VBKKVCAEESABGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-8(2)7-9(11)3-5-10-6-4-9/h10-11H,1,3-7H2,2H3.
What are the key properties of 4-(2-methylprop-2-enyl)piperidin-4-ol?
4-(2-methylprop-2-enyl)piperidin-4-ol has a molecular weight of 155.24 g/mol, XLogP of 1.07, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylprop-2-enyl)piperidin-4-ol is sourced from PubChem (CID 123241473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).