3-pyrrolidin-1-ylcyclobutan-1-ol;hydrochloride

C8H16ClNO — CID 112756665

IUPAC3-pyrrolidin-1-ylcyclobutan-1-ol;hydrochloride
SMILESCl.OC1CC(N2CCCC2)C1
InChIInChI=1S/C8H15NO.ClH/c10-8-5-7(6-8)9-3-1-2-4-9;/h7-8,10H,1-6H2;1H
InChIKeyQPRVSAXQIKHOND-UHFFFAOYSA-N
MW177.67 g/mol
LogP1.03
Rot. Bonds1

About 3-pyrrolidin-1-ylcyclobutan-1-ol;hydrochloride

3-pyrrolidin-1-ylcyclobutan-1-ol;hydrochloride (PubChem CID 112756665) has the molecular formula C8H16ClNO and a molecular weight of 177.67 g/mol. Its IUPAC name is 3-pyrrolidin-1-ylcyclobutan-1-ol;hydrochloride.

Molecular Properties

Compound Name3-pyrrolidin-1-ylcyclobutan-1-ol;hydrochloride
PubChem CID112756665
Molecular FormulaC8H16ClNO
Molecular Weight177.67 g/mol
Exact Mass177.09
IUPAC Name3-pyrrolidin-1-ylcyclobutan-1-ol;hydrochloride
SMILESCl.OC1CC(N2CCCC2)C1
InChIInChI=1S/C8H15NO.ClH/c10-8-5-7(6-8)9-3-1-2-4-9;/h7-8,10H,1-6H2;1H
InChIKeyQPRVSAXQIKHOND-UHFFFAOYSA-N
XLogP1.03
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.67
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-pyrrolidin-1-ylcyclobutan-1-ol;hydrochloride?
The IUPAC name of 3-pyrrolidin-1-ylcyclobutan-1-ol;hydrochloride (CID 112756665) is 3-pyrrolidin-1-ylcyclobutan-1-ol;hydrochloride.
What is the SMILES notation for 3-pyrrolidin-1-ylcyclobutan-1-ol;hydrochloride?
The canonical SMILES for 3-pyrrolidin-1-ylcyclobutan-1-ol;hydrochloride is Cl.OC1CC(N2CCCC2)C1.
What is the InChIKey of 3-pyrrolidin-1-ylcyclobutan-1-ol;hydrochloride?
The InChIKey is QPRVSAXQIKHOND-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO.ClH/c10-8-5-7(6-8)9-3-1-2-4-9;/h7-8,10H,1-6H2;1H.
What are the key properties of 3-pyrrolidin-1-ylcyclobutan-1-ol;hydrochloride?
3-pyrrolidin-1-ylcyclobutan-1-ol;hydrochloride has a molecular weight of 177.67 g/mol, XLogP of 1.03, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyrrolidin-1-ylcyclobutan-1-ol;hydrochloride is sourced from PubChem (CID 112756665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).