1-(1,3-dihydroxycyclopentyl)cyclopentane-1,2-diol

C10H18O4 — CID 90694398

IUPAC1-(1,3-dihydroxycyclopentyl)cyclopentane-1,2-diol
SMILESOC1CCC(O)(C2(O)CCCC2O)C1
InChIInChI=1S/C10H18O4/c11-7-3-5-9(13,6-7)10(14)4-1-2-8(10)12/h7-8,11-14H,1-6H2
InChIKeyVGTQXFBMQBFMQF-UHFFFAOYSA-N
MW202.25 g/mol
LogP-0.46
Rot. Bonds1

About 1-(1,3-dihydroxycyclopentyl)cyclopentane-1,2-diol

1-(1,3-dihydroxycyclopentyl)cyclopentane-1,2-diol (PubChem CID 90694398) has the molecular formula C10H18O4 and a molecular weight of 202.25 g/mol. Its IUPAC name is 1-(1,3-dihydroxycyclopentyl)cyclopentane-1,2-diol.

Molecular Properties

Compound Name1-(1,3-dihydroxycyclopentyl)cyclopentane-1,2-diol
PubChem CID90694398
Molecular FormulaC10H18O4
Molecular Weight202.25 g/mol
Exact Mass202.12
IUPAC Name1-(1,3-dihydroxycyclopentyl)cyclopentane-1,2-diol
SMILESOC1CCC(O)(C2(O)CCCC2O)C1
InChIInChI=1S/C10H18O4/c11-7-3-5-9(13,6-7)10(14)4-1-2-8(10)12/h7-8,11-14H,1-6H2
InChIKeyVGTQXFBMQBFMQF-UHFFFAOYSA-N
XLogP-0.46
TPSA80.92 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.25
LogP ≤ 5-0.46
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

cyclopentane-1,1,2-triol
CID 19830380
1-fluorocyclohexane-1,3-diol
CID 175445441
(4S,5R,10R)-spiro[4.5]decane-4,10-diol
CID 14934378
(4S,5R)-spiro[4.5]decane-4,10-diol
CID 135069767
(8S,9R,10R,13S,14S)-10,13-dimethyl-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,5,17-triol
CID 57056342
cis-(1S,3S)-1-phenylcyclohexane-1,3-diol
CID 130757537
(3S,5R,10R,13S,17S)-10,13,17-trimethyl-2,3,4,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthrene-3,5,17-triol
CID 171976768
(6S)-2-azaspiro[3.4]octan-6-ol
CID 139512548
1,2,3,4,5,6,7,7a-octahydroindene-3a,4-diol
CID 13396648
(1S,3R,6R)-tricyclo[4.4.2.01,6]dodecan-3-ol
CID 98162186
(4S,5R,12R)-spiro[4.7]dodecane-4,12-diol
CID 11127251
2-(1,2-dihydroxycyclopentyl)acetonitrile
CID 130142856

Frequently Asked Questions

What is the IUPAC name of 1-(1,3-dihydroxycyclopentyl)cyclopentane-1,2-diol?
The IUPAC name of 1-(1,3-dihydroxycyclopentyl)cyclopentane-1,2-diol (CID 90694398) is 1-(1,3-dihydroxycyclopentyl)cyclopentane-1,2-diol.
What is the SMILES notation for 1-(1,3-dihydroxycyclopentyl)cyclopentane-1,2-diol?
The canonical SMILES for 1-(1,3-dihydroxycyclopentyl)cyclopentane-1,2-diol is OC1CCC(O)(C2(O)CCCC2O)C1.
What is the InChIKey of 1-(1,3-dihydroxycyclopentyl)cyclopentane-1,2-diol?
The InChIKey is VGTQXFBMQBFMQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O4/c11-7-3-5-9(13,6-7)10(14)4-1-2-8(10)12/h7-8,11-14H,1-6H2.
What are the key properties of 1-(1,3-dihydroxycyclopentyl)cyclopentane-1,2-diol?
1-(1,3-dihydroxycyclopentyl)cyclopentane-1,2-diol has a molecular weight of 202.25 g/mol, XLogP of -0.46, 1 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,3-dihydroxycyclopentyl)cyclopentane-1,2-diol is sourced from PubChem (CID 90694398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).