cis-(1R,2S)-2-aminocyclopentan-1-ol;cis-(1S,2R)-2-aminocyclopentan-1-ol;dihydrochloride

C10H24Cl2N2O2 — CID 171920852

IUPACcis-(1R,2S)-2-aminocyclopentan-1-ol;cis-(1S,2R)-2-aminocyclopentan-1-ol;dihydrochloride
SMILESCl.Cl.N[C@@H]1CCC[C@@H]1O.N[C@H]1CCC[C@H]1O
InChIInChI=1S/2C5H11NO.2ClH/c2*6-4-2-1-3-5(4)7;;/h2*4-5,7H,1-3,6H2;2*1H/t2*4-,5+;;/m10../s1
InChIKeyLXYDCMWIZIJRDF-FZUHBSIMSA-N
MW275.22 g/mol
LogP0.56
Rot. Bonds

About cis-(1R,2S)-2-aminocyclopentan-1-ol;cis-(1S,2R)-2-aminocyclopentan-1-ol;dihydrochloride

cis-(1R,2S)-2-aminocyclopentan-1-ol;cis-(1S,2R)-2-aminocyclopentan-1-ol;dihydrochloride (PubChem CID 171920852) has the molecular formula C10H24Cl2N2O2 and a molecular weight of 275.22 g/mol. Its IUPAC name is cis-(1R,2S)-2-aminocyclopentan-1-ol;cis-(1S,2R)-2-aminocyclopentan-1-ol;dihydrochloride.

Molecular Properties

Compound Namecis-(1R,2S)-2-aminocyclopentan-1-ol;cis-(1S,2R)-2-aminocyclopentan-1-ol;dihydrochloride
PubChem CID171920852
Molecular FormulaC10H24Cl2N2O2
Molecular Weight275.22 g/mol
Exact Mass274.12
IUPAC Namecis-(1R,2S)-2-aminocyclopentan-1-ol;cis-(1S,2R)-2-aminocyclopentan-1-ol;dihydrochloride
SMILESCl.Cl.N[C@@H]1CCC[C@@H]1O.N[C@H]1CCC[C@H]1O
InChIInChI=1S/2C5H11NO.2ClH/c2*6-4-2-1-3-5(4)7;;/h2*4-5,7H,1-3,6H2;2*1H/t2*4-,5+;;/m10../s1
InChIKeyLXYDCMWIZIJRDF-FZUHBSIMSA-N
XLogP0.56
TPSA92.50 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.22
LogP ≤ 50.56
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of cis-(1R,2S)-2-aminocyclopentan-1-ol;cis-(1S,2R)-2-aminocyclopentan-1-ol;dihydrochloride?
The IUPAC name of cis-(1R,2S)-2-aminocyclopentan-1-ol;cis-(1S,2R)-2-aminocyclopentan-1-ol;dihydrochloride (CID 171920852) is cis-(1R,2S)-2-aminocyclopentan-1-ol;cis-(1S,2R)-2-aminocyclopentan-1-ol;dihydrochloride.
What is the SMILES notation for cis-(1R,2S)-2-aminocyclopentan-1-ol;cis-(1S,2R)-2-aminocyclopentan-1-ol;dihydrochloride?
The canonical SMILES for cis-(1R,2S)-2-aminocyclopentan-1-ol;cis-(1S,2R)-2-aminocyclopentan-1-ol;dihydrochloride is Cl.Cl.N[C@@H]1CCC[C@@H]1O.N[C@H]1CCC[C@H]1O.
What is the InChIKey of cis-(1R,2S)-2-aminocyclopentan-1-ol;cis-(1S,2R)-2-aminocyclopentan-1-ol;dihydrochloride?
The InChIKey is LXYDCMWIZIJRDF-FZUHBSIMSA-N. The full InChI is InChI=1S/2C5H11NO.2ClH/c2*6-4-2-1-3-5(4)7;;/h2*4-5,7H,1-3,6H2;2*1H/t2*4-,5+;;/m10../s1.
What are the key properties of cis-(1R,2S)-2-aminocyclopentan-1-ol;cis-(1S,2R)-2-aminocyclopentan-1-ol;dihydrochloride?
cis-(1R,2S)-2-aminocyclopentan-1-ol;cis-(1S,2R)-2-aminocyclopentan-1-ol;dihydrochloride has a molecular weight of 275.22 g/mol, XLogP of 0.56, 0 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,2S)-2-aminocyclopentan-1-ol;cis-(1S,2R)-2-aminocyclopentan-1-ol;dihydrochloride is sourced from PubChem (CID 171920852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).