2-pyrrolidin-1-ylbicyclo[3.2.1]octan-8-ol;hydrochloride

C12H22ClNO — CID 50985681

IUPAC2-pyrrolidin-1-ylbicyclo[3.2.1]octan-8-ol;hydrochloride
SMILESCl.OC1C2CCC1C(N1CCCC1)CC2
InChIInChI=1S/C12H21NO.ClH/c14-12-9-3-5-10(12)11(6-4-9)13-7-1-2-8-13;/h9-12,14H,1-8H2;1H
InChIKeyBRDOYOSOUNXBGJ-UHFFFAOYSA-N
MW231.77 g/mol
LogP2.05
Rot. Bonds1

About 2-pyrrolidin-1-ylbicyclo[3.2.1]octan-8-ol;hydrochloride

2-pyrrolidin-1-ylbicyclo[3.2.1]octan-8-ol;hydrochloride (PubChem CID 50985681) has the molecular formula C12H22ClNO and a molecular weight of 231.77 g/mol. Its IUPAC name is 2-pyrrolidin-1-ylbicyclo[3.2.1]octan-8-ol;hydrochloride.

Molecular Properties

Compound Name2-pyrrolidin-1-ylbicyclo[3.2.1]octan-8-ol;hydrochloride
PubChem CID50985681
Molecular FormulaC12H22ClNO
Molecular Weight231.77 g/mol
Exact Mass231.14
IUPAC Name2-pyrrolidin-1-ylbicyclo[3.2.1]octan-8-ol;hydrochloride
SMILESCl.OC1C2CCC1C(N1CCCC1)CC2
InChIInChI=1S/C12H21NO.ClH/c14-12-9-3-5-10(12)11(6-4-9)13-7-1-2-8-13;/h9-12,14H,1-8H2;1H
InChIKeyBRDOYOSOUNXBGJ-UHFFFAOYSA-N
XLogP2.05
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.77
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-pyrrolidin-1-ylbicyclo[3.2.1]octan-8-ol;hydrochloride?
The IUPAC name of 2-pyrrolidin-1-ylbicyclo[3.2.1]octan-8-ol;hydrochloride (CID 50985681) is 2-pyrrolidin-1-ylbicyclo[3.2.1]octan-8-ol;hydrochloride.
What is the SMILES notation for 2-pyrrolidin-1-ylbicyclo[3.2.1]octan-8-ol;hydrochloride?
The canonical SMILES for 2-pyrrolidin-1-ylbicyclo[3.2.1]octan-8-ol;hydrochloride is Cl.OC1C2CCC1C(N1CCCC1)CC2.
What is the InChIKey of 2-pyrrolidin-1-ylbicyclo[3.2.1]octan-8-ol;hydrochloride?
The InChIKey is BRDOYOSOUNXBGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO.ClH/c14-12-9-3-5-10(12)11(6-4-9)13-7-1-2-8-13;/h9-12,14H,1-8H2;1H.
What are the key properties of 2-pyrrolidin-1-ylbicyclo[3.2.1]octan-8-ol;hydrochloride?
2-pyrrolidin-1-ylbicyclo[3.2.1]octan-8-ol;hydrochloride has a molecular weight of 231.77 g/mol, XLogP of 2.05, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrrolidin-1-ylbicyclo[3.2.1]octan-8-ol;hydrochloride is sourced from PubChem (CID 50985681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).