trans-(1S,2S)-2-[2-(hydroxymethyl)piperidin-1-yl]cyclopentan-1-ol

C11H21NO2 — CID 102734441

IUPACtrans-(1S,2S)-2-[2-(hydroxymethyl)piperidin-1-yl]cyclopentan-1-ol
SMILESOCC1CCCCN1[C@H]1CCC[C@@H]1O
InChIInChI=1S/C11H21NO2/c13-8-9-4-1-2-7-12(9)10-5-3-6-11(10)14/h9-11,13-14H,1-8H2/t9?,10-,11-/m0/s1
InChIKeyRZNDVCPBRXFKHQ-DVRYWGNFSA-N
MW199.29 g/mol
LogP0.75
Rot. Bonds2

About trans-(1S,2S)-2-[2-(hydroxymethyl)piperidin-1-yl]cyclopentan-1-ol

trans-(1S,2S)-2-[2-(hydroxymethyl)piperidin-1-yl]cyclopentan-1-ol (PubChem CID 102734441) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is trans-(1S,2S)-2-[2-(hydroxymethyl)piperidin-1-yl]cyclopentan-1-ol.

Molecular Properties

Compound Nametrans-(1S,2S)-2-[2-(hydroxymethyl)piperidin-1-yl]cyclopentan-1-ol
PubChem CID102734441
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Nametrans-(1S,2S)-2-[2-(hydroxymethyl)piperidin-1-yl]cyclopentan-1-ol
SMILESOCC1CCCCN1[C@H]1CCC[C@@H]1O
InChIInChI=1S/C11H21NO2/c13-8-9-4-1-2-7-12(9)10-5-3-6-11(10)14/h9-11,13-14H,1-8H2/t9?,10-,11-/m0/s1
InChIKeyRZNDVCPBRXFKHQ-DVRYWGNFSA-N
XLogP0.75
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

trans-(1S,2S)-2-(2-ethylpiperidin-1-yl)cyclohexan-1-ol
CID 102731877
trans-(1R,2R)-2-(2-propylpiperidin-1-yl)cyclopentan-1-ol
CID 102734913
2-[2-(2-hydroxypropyl)piperidin-1-yl]cyclopentan-1-ol
CID 114338292
(3R,4R)-4-[(2S)-2-(hydroxymethyl)piperidin-1-yl]pyrrolidin-3-ol
CID 130906068
2-[2-(hydroxymethyl)piperidin-1-yl]cycloheptane-1-carbonitrile
CID 61406591
trans-(1R,2R)-2-[3-(hydroxymethyl)thiomorpholin-4-yl]cyclopentan-1-ol
CID 122237299
trans-(1R,2R)-2-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]cyclohexan-1-ol
CID 102732104
trans-(1S,2S)-2-(2-methylpiperidin-1-yl)cyclopentan-1-ol
CID 102734292
1-[(1S,2S)-2-hydroxycyclopentyl]-5-(hydroxymethyl)pyrrolidin-3-ol
CID 164661796
trans-(1S,2S)-2-(2-methylazepan-1-yl)cyclopentan-1-ol
CID 102734781
[1-[2-(aminomethyl)cyclohexyl]pyrrolidin-2-yl]methanol
CID 61407519
2-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)cyclooctan-1-ol
CID 65319710

Frequently Asked Questions

What is the IUPAC name of trans-(1S,2S)-2-[2-(hydroxymethyl)piperidin-1-yl]cyclopentan-1-ol?
The IUPAC name of trans-(1S,2S)-2-[2-(hydroxymethyl)piperidin-1-yl]cyclopentan-1-ol (CID 102734441) is trans-(1S,2S)-2-[2-(hydroxymethyl)piperidin-1-yl]cyclopentan-1-ol.
What is the SMILES notation for trans-(1S,2S)-2-[2-(hydroxymethyl)piperidin-1-yl]cyclopentan-1-ol?
The canonical SMILES for trans-(1S,2S)-2-[2-(hydroxymethyl)piperidin-1-yl]cyclopentan-1-ol is OCC1CCCCN1[C@H]1CCC[C@@H]1O.
What is the InChIKey of trans-(1S,2S)-2-[2-(hydroxymethyl)piperidin-1-yl]cyclopentan-1-ol?
The InChIKey is RZNDVCPBRXFKHQ-DVRYWGNFSA-N. The full InChI is InChI=1S/C11H21NO2/c13-8-9-4-1-2-7-12(9)10-5-3-6-11(10)14/h9-11,13-14H,1-8H2/t9?,10-,11-/m0/s1.
What are the key properties of trans-(1S,2S)-2-[2-(hydroxymethyl)piperidin-1-yl]cyclopentan-1-ol?
trans-(1S,2S)-2-[2-(hydroxymethyl)piperidin-1-yl]cyclopentan-1-ol has a molecular weight of 199.29 g/mol, XLogP of 0.75, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1S,2S)-2-[2-(hydroxymethyl)piperidin-1-yl]cyclopentan-1-ol is sourced from PubChem (CID 102734441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).