cis-(1S,2R)-2-(methylamino)cyclopentan-1-ol

C6H13NO — CID 15696256

IUPACcis-(1S,2R)-2-(methylamino)cyclopentan-1-ol
SMILESCN[C@@H]1CCC[C@@H]1O
InChIInChI=1S/C6H13NO/c1-7-5-3-2-4-6(5)8/h5-8H,2-4H2,1H3/t5-,6+/m1/s1
InChIKeyYAEYCYRQJINORB-RITPCOANSA-N
MW115.18 g/mol
LogP0.12
Rot. Bonds1

About cis-(1S,2R)-2-(methylamino)cyclopentan-1-ol

cis-(1S,2R)-2-(methylamino)cyclopentan-1-ol (PubChem CID 15696256) has the molecular formula C6H13NO and a molecular weight of 115.18 g/mol. Its IUPAC name is cis-(1S,2R)-2-(methylamino)cyclopentan-1-ol.

Molecular Properties

Compound Namecis-(1S,2R)-2-(methylamino)cyclopentan-1-ol
PubChem CID15696256
Molecular FormulaC6H13NO
Molecular Weight115.18 g/mol
Exact Mass115.10
IUPAC Namecis-(1S,2R)-2-(methylamino)cyclopentan-1-ol
SMILESCN[C@@H]1CCC[C@@H]1O
InChIInChI=1S/C6H13NO/c1-7-5-3-2-4-6(5)8/h5-8H,2-4H2,1H3/t5-,6+/m1/s1
InChIKeyYAEYCYRQJINORB-RITPCOANSA-N
XLogP0.12
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.18
LogP ≤ 50.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cis-(1S,2R)-2-(methylamino)cyclopentan-1-ol?
The IUPAC name of cis-(1S,2R)-2-(methylamino)cyclopentan-1-ol (CID 15696256) is cis-(1S,2R)-2-(methylamino)cyclopentan-1-ol.
What is the SMILES notation for cis-(1S,2R)-2-(methylamino)cyclopentan-1-ol?
The canonical SMILES for cis-(1S,2R)-2-(methylamino)cyclopentan-1-ol is CN[C@@H]1CCC[C@@H]1O.
What is the InChIKey of cis-(1S,2R)-2-(methylamino)cyclopentan-1-ol?
The InChIKey is YAEYCYRQJINORB-RITPCOANSA-N. The full InChI is InChI=1S/C6H13NO/c1-7-5-3-2-4-6(5)8/h5-8H,2-4H2,1H3/t5-,6+/m1/s1.
What are the key properties of cis-(1S,2R)-2-(methylamino)cyclopentan-1-ol?
cis-(1S,2R)-2-(methylamino)cyclopentan-1-ol has a molecular weight of 115.18 g/mol, XLogP of 0.12, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1S,2R)-2-(methylamino)cyclopentan-1-ol is sourced from PubChem (CID 15696256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).