1-[(2R)-2-methylbut-3-enyl]piperidin-4-ol

C10H19NO — CID 156885258

IUPAC1-[(2R)-2-methylbut-3-enyl]piperidin-4-ol
SMILESC=C[C@@H](C)CN1CCC(O)CC1
InChIInChI=1S/C10H19NO/c1-3-9(2)8-11-6-4-10(12)5-7-11/h3,9-10,12H,1,4-8H2,2H3/t9-/m1/s1
InChIKeyRYRFVZQDKKDAPE-SECBINFHSA-N
MW169.27 g/mol
LogP1.27
Rot. Bonds3

About 1-[(2R)-2-methylbut-3-enyl]piperidin-4-ol

1-[(2R)-2-methylbut-3-enyl]piperidin-4-ol (PubChem CID 156885258) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 1-[(2R)-2-methylbut-3-enyl]piperidin-4-ol.

Molecular Properties

Compound Name1-[(2R)-2-methylbut-3-enyl]piperidin-4-ol
PubChem CID156885258
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name1-[(2R)-2-methylbut-3-enyl]piperidin-4-ol
SMILESC=C[C@@H](C)CN1CCC(O)CC1
InChIInChI=1S/C10H19NO/c1-3-9(2)8-11-6-4-10(12)5-7-11/h3,9-10,12H,1,4-8H2,2H3/t9-/m1/s1
InChIKeyRYRFVZQDKKDAPE-SECBINFHSA-N
XLogP1.27
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.27
H-Bond Donors ≤ 51
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 1-[(2R)-2-methylbut-3-enyl]piperidin-4-ol?
The IUPAC name of 1-[(2R)-2-methylbut-3-enyl]piperidin-4-ol (CID 156885258) is 1-[(2R)-2-methylbut-3-enyl]piperidin-4-ol.
What is the SMILES notation for 1-[(2R)-2-methylbut-3-enyl]piperidin-4-ol?
The canonical SMILES for 1-[(2R)-2-methylbut-3-enyl]piperidin-4-ol is C=C[C@@H](C)CN1CCC(O)CC1.
What is the InChIKey of 1-[(2R)-2-methylbut-3-enyl]piperidin-4-ol?
The InChIKey is RYRFVZQDKKDAPE-SECBINFHSA-N. The full InChI is InChI=1S/C10H19NO/c1-3-9(2)8-11-6-4-10(12)5-7-11/h3,9-10,12H,1,4-8H2,2H3/t9-/m1/s1.
What are the key properties of 1-[(2R)-2-methylbut-3-enyl]piperidin-4-ol?
1-[(2R)-2-methylbut-3-enyl]piperidin-4-ol has a molecular weight of 169.27 g/mol, XLogP of 1.27, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2R)-2-methylbut-3-enyl]piperidin-4-ol is sourced from PubChem (CID 156885258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).