trans-(1S,2S)-2-(2-cyclobutylethylamino)cyclopentan-1-ol

C11H21NO — CID 102734088

IUPACtrans-(1S,2S)-2-(2-cyclobutylethylamino)cyclopentan-1-ol
SMILESO[C@H]1CCC[C@@H]1NCCC1CCC1
InChIInChI=1S/C11H21NO/c13-11-6-2-5-10(11)12-8-7-9-3-1-4-9/h9-13H,1-8H2/t10-,11-/m0/s1
InChIKeyJNKSKYLNQATNPY-QWRGUYRKSA-N
MW183.29 g/mol
LogP1.68
Rot. Bonds4

About trans-(1S,2S)-2-(2-cyclobutylethylamino)cyclopentan-1-ol

trans-(1S,2S)-2-(2-cyclobutylethylamino)cyclopentan-1-ol (PubChem CID 102734088) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is trans-(1S,2S)-2-(2-cyclobutylethylamino)cyclopentan-1-ol.

Molecular Properties

Compound Nametrans-(1S,2S)-2-(2-cyclobutylethylamino)cyclopentan-1-ol
PubChem CID102734088
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Nametrans-(1S,2S)-2-(2-cyclobutylethylamino)cyclopentan-1-ol
SMILESO[C@H]1CCC[C@@H]1NCCC1CCC1
InChIInChI=1S/C11H21NO/c13-11-6-2-5-10(11)12-8-7-9-3-1-4-9/h9-13H,1-8H2/t10-,11-/m0/s1
InChIKeyJNKSKYLNQATNPY-QWRGUYRKSA-N
XLogP1.68
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

trans-(1R,2R)-2-(2-cyclopropylethylamino)cyclopentan-1-ol
CID 102733634
trans-(1R,2R)-2-(3-cyclopropylpropylamino)cyclohexan-1-ol
CID 102731748
trans-(1S,2S)-2-[2-[[(1R,2S)-2-hydroxycyclohexyl]amino]ethylamino]cyclohexan-1-ol
CID 92759264
trans-(1S,2S)-2-(cyclopentylmethylamino)cyclopentan-1-ol
CID 93345953
trans-(1R,2R)-2-(2-aminoethylamino)cyclopentan-1-ol
CID 55289731
trans-(1S,2S)-2-(cyclobutylmethylamino)cyclohexan-1-ol
CID 93346202
trans-(1R,2R)-2-(3,3,3-trifluoropropylamino)cyclopentan-1-ol
CID 102733446
4-(2-cyclobutylethylamino)cyclohexan-1-ol
CID 106595151
trans-(1S,2S)-2-(cyclohexylmethylamino)cyclohexan-1-ol
CID 11615431
cis-(1S,2R)-2-(cyclohexylmethylamino)cyclohexan-1-ol
CID 51614343
2-(3,3-dimethylbutylamino)cyclohexan-1-ol
CID 62359482
2-(2,2-dimethylpropylamino)cyclopentan-1-ol
CID 61166650

Frequently Asked Questions

What is the IUPAC name of trans-(1S,2S)-2-(2-cyclobutylethylamino)cyclopentan-1-ol?
The IUPAC name of trans-(1S,2S)-2-(2-cyclobutylethylamino)cyclopentan-1-ol (CID 102734088) is trans-(1S,2S)-2-(2-cyclobutylethylamino)cyclopentan-1-ol.
What is the SMILES notation for trans-(1S,2S)-2-(2-cyclobutylethylamino)cyclopentan-1-ol?
The canonical SMILES for trans-(1S,2S)-2-(2-cyclobutylethylamino)cyclopentan-1-ol is O[C@H]1CCC[C@@H]1NCCC1CCC1.
What is the InChIKey of trans-(1S,2S)-2-(2-cyclobutylethylamino)cyclopentan-1-ol?
The InChIKey is JNKSKYLNQATNPY-QWRGUYRKSA-N. The full InChI is InChI=1S/C11H21NO/c13-11-6-2-5-10(11)12-8-7-9-3-1-4-9/h9-13H,1-8H2/t10-,11-/m0/s1.
What are the key properties of trans-(1S,2S)-2-(2-cyclobutylethylamino)cyclopentan-1-ol?
trans-(1S,2S)-2-(2-cyclobutylethylamino)cyclopentan-1-ol has a molecular weight of 183.29 g/mol, XLogP of 1.68, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1S,2S)-2-(2-cyclobutylethylamino)cyclopentan-1-ol is sourced from PubChem (CID 102734088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).