cyclopentanol;dihydrochloride

C5H12Cl2O — CID 86599054

IUPACcyclopentanol;dihydrochloride
SMILESCl.Cl.OC1CCCC1
InChIInChI=1S/C5H10O.2ClH/c6-5-3-1-2-4-5;;/h5-6H,1-4H2;2*1H
InChIKeySNKYLLGDJMEMCT-UHFFFAOYSA-N
MW159.06 g/mol
LogP1.76
Rot. Bonds

About cyclopentanol;dihydrochloride

cyclopentanol;dihydrochloride (PubChem CID 86599054) has the molecular formula C5H12Cl2O and a molecular weight of 159.06 g/mol. Its IUPAC name is cyclopentanol;dihydrochloride.

Molecular Properties

Compound Namecyclopentanol;dihydrochloride
PubChem CID86599054
Molecular FormulaC5H12Cl2O
Molecular Weight159.06 g/mol
Exact Mass158.03
IUPAC Namecyclopentanol;dihydrochloride
SMILESCl.Cl.OC1CCCC1
InChIInChI=1S/C5H10O.2ClH/c6-5-3-1-2-4-5;;/h5-6H,1-4H2;2*1H
InChIKeySNKYLLGDJMEMCT-UHFFFAOYSA-N
XLogP1.76
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.06
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of cyclopentanol;dihydrochloride?
The IUPAC name of cyclopentanol;dihydrochloride (CID 86599054) is cyclopentanol;dihydrochloride.
What is the SMILES notation for cyclopentanol;dihydrochloride?
The canonical SMILES for cyclopentanol;dihydrochloride is Cl.Cl.OC1CCCC1.
What is the InChIKey of cyclopentanol;dihydrochloride?
The InChIKey is SNKYLLGDJMEMCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10O.2ClH/c6-5-3-1-2-4-5;;/h5-6H,1-4H2;2*1H.
What are the key properties of cyclopentanol;dihydrochloride?
cyclopentanol;dihydrochloride has a molecular weight of 159.06 g/mol, XLogP of 1.76, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentanol;dihydrochloride is sourced from PubChem (CID 86599054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).