4-tert-butylpiperidin-3-ol;hydrochloride

C9H20ClNO — CID 71758200

IUPAC4-tert-butylpiperidin-3-ol;hydrochloride
SMILESCC(C)(C)C1CCNCC1O.Cl
InChIInChI=1S/C9H19NO.ClH/c1-9(2,3)7-4-5-10-6-8(7)11;/h7-8,10-11H,4-6H2,1-3H3;1H
InChIKeyBWKNTLXHSWBGFC-UHFFFAOYSA-N
MW193.72 g/mol
LogP1.42
Rot. Bonds

About 4-tert-butylpiperidin-3-ol;hydrochloride

4-tert-butylpiperidin-3-ol;hydrochloride (PubChem CID 71758200) has the molecular formula C9H20ClNO and a molecular weight of 193.72 g/mol. Its IUPAC name is 4-tert-butylpiperidin-3-ol;hydrochloride.

Molecular Properties

Compound Name4-tert-butylpiperidin-3-ol;hydrochloride
PubChem CID71758200
Molecular FormulaC9H20ClNO
Molecular Weight193.72 g/mol
Exact Mass193.12
IUPAC Name4-tert-butylpiperidin-3-ol;hydrochloride
SMILESCC(C)(C)C1CCNCC1O.Cl
InChIInChI=1S/C9H19NO.ClH/c1-9(2,3)7-4-5-10-6-8(7)11;/h7-8,10-11H,4-6H2,1-3H3;1H
InChIKeyBWKNTLXHSWBGFC-UHFFFAOYSA-N
XLogP1.42
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.72
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-tert-butylpiperidin-3-ol;hydrochloride?
The IUPAC name of 4-tert-butylpiperidin-3-ol;hydrochloride (CID 71758200) is 4-tert-butylpiperidin-3-ol;hydrochloride.
What is the SMILES notation for 4-tert-butylpiperidin-3-ol;hydrochloride?
The canonical SMILES for 4-tert-butylpiperidin-3-ol;hydrochloride is CC(C)(C)C1CCNCC1O.Cl.
What is the InChIKey of 4-tert-butylpiperidin-3-ol;hydrochloride?
The InChIKey is BWKNTLXHSWBGFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO.ClH/c1-9(2,3)7-4-5-10-6-8(7)11;/h7-8,10-11H,4-6H2,1-3H3;1H.
What are the key properties of 4-tert-butylpiperidin-3-ol;hydrochloride?
4-tert-butylpiperidin-3-ol;hydrochloride has a molecular weight of 193.72 g/mol, XLogP of 1.42, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butylpiperidin-3-ol;hydrochloride is sourced from PubChem (CID 71758200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).