cis-(1R,2S)-cyclopentane-1,2,4-triol

C5H10O3 — CID 11073392

IUPACcis-(1R,2S)-cyclopentane-1,2,4-triol
SMILESOC1C[C@@H](O)[C@@H](O)C1
InChIInChI=1S/C5H10O3/c6-3-1-4(7)5(8)2-3/h3-8H,1-2H2/t3?,4-,5+
InChIKeyXMIAGKTYUJDZNV-NVGWPGHNSA-N
MW118.13 g/mol
LogP-1.14
Rot. Bonds

About cis-(1R,2S)-cyclopentane-1,2,4-triol

cis-(1R,2S)-cyclopentane-1,2,4-triol (PubChem CID 11073392) has the molecular formula C5H10O3 and a molecular weight of 118.13 g/mol. Its IUPAC name is cis-(1R,2S)-cyclopentane-1,2,4-triol.

Molecular Properties

Compound Namecis-(1R,2S)-cyclopentane-1,2,4-triol
PubChem CID11073392
Molecular FormulaC5H10O3
Molecular Weight118.13 g/mol
Exact Mass118.06
IUPAC Namecis-(1R,2S)-cyclopentane-1,2,4-triol
SMILESOC1C[C@@H](O)[C@@H](O)C1
InChIInChI=1S/C5H10O3/c6-3-1-4(7)5(8)2-3/h3-8H,1-2H2/t3?,4-,5+
InChIKeyXMIAGKTYUJDZNV-NVGWPGHNSA-N
XLogP-1.14
TPSA60.69 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.13
LogP ≤ 5-1.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

trans-(1R,2R)-cyclopropane-1,2-diol
CID 59075452
trans-(1R,3R)-cyclohexane-1,2,3,5-tetrol
CID 45102944
cyclobutane-1,3-diol
CID 175518786
(1S,2S,4S,5S)-cyclohexane-1,2,4,5-tetrol
CID 10855621
4-(hydroxymethyl)cyclopentane-1,3-diol
CID 57158544
(1S,5S)-8-methyl-8-azabicyclo[3.2.1]oct-6-en-3-ol
CID 14403146
boric acid;cyclohexane-1,3,5-triol
CID 67659850
[3-(dihydroxymethyl)-5-hydroxycyclohexyl]methanediol
CID 5255256
8-methyl-8-azabicyclo[3.2.1]oct-6-en-3-ol;hydrochloride
CID 10419695
4,5-dimethylcyclohexane-1,2-diol
CID 13429582
(1R,3R,4S)-4-propan-2-ylcyclohexane-1,3-diol
CID 130918219
1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-1,3,5-triol
CID 58860261

Frequently Asked Questions

What is the IUPAC name of cis-(1R,2S)-cyclopentane-1,2,4-triol?
The IUPAC name of cis-(1R,2S)-cyclopentane-1,2,4-triol (CID 11073392) is cis-(1R,2S)-cyclopentane-1,2,4-triol.
What is the SMILES notation for cis-(1R,2S)-cyclopentane-1,2,4-triol?
The canonical SMILES for cis-(1R,2S)-cyclopentane-1,2,4-triol is OC1C[C@@H](O)[C@@H](O)C1.
What is the InChIKey of cis-(1R,2S)-cyclopentane-1,2,4-triol?
The InChIKey is XMIAGKTYUJDZNV-NVGWPGHNSA-N. The full InChI is InChI=1S/C5H10O3/c6-3-1-4(7)5(8)2-3/h3-8H,1-2H2/t3?,4-,5+.
What are the key properties of cis-(1R,2S)-cyclopentane-1,2,4-triol?
cis-(1R,2S)-cyclopentane-1,2,4-triol has a molecular weight of 118.13 g/mol, XLogP of -1.14, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,2S)-cyclopentane-1,2,4-triol is sourced from PubChem (CID 11073392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).