trans-(1R,2R)-cyclopropane-1,2-diol

C3H6O2 — CID 59075452

IUPACtrans-(1R,2R)-cyclopropane-1,2-diol
SMILESO[C@@H]1C[C@H]1O
InChIInChI=1S/C3H6O2/c4-2-1-3(2)5/h2-5H,1H2/t2-,3-/m1/s1
InChIKeyBTWIMZVCLMHNAV-PWNYCUMCSA-N
MW74.08 g/mol
LogP-0.89
Rot. Bonds

About trans-(1R,2R)-cyclopropane-1,2-diol

trans-(1R,2R)-cyclopropane-1,2-diol (PubChem CID 59075452) has the molecular formula C3H6O2 and a molecular weight of 74.08 g/mol. Its IUPAC name is trans-(1R,2R)-cyclopropane-1,2-diol.

Molecular Properties

Compound Nametrans-(1R,2R)-cyclopropane-1,2-diol
PubChem CID59075452
Molecular FormulaC3H6O2
Molecular Weight74.08 g/mol
Exact Mass74.04
IUPAC Nametrans-(1R,2R)-cyclopropane-1,2-diol
SMILESO[C@@H]1C[C@H]1O
InChIInChI=1S/C3H6O2/c4-2-1-3(2)5/h2-5H,1H2/t2-,3-/m1/s1
InChIKeyBTWIMZVCLMHNAV-PWNYCUMCSA-N
XLogP-0.89
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50074.08
LogP ≤ 5-0.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze trans-(1R,2R)-cyclopropane-1,2-diol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1S,2S,4S,5S)-cyclohexane-1,2,4,5-tetrol
CID 10855621
cis-(1R,2S)-cyclopentane-1,2,4-triol
CID 11073392
4,5-dimethylcyclohexane-1,2-diol
CID 13429582
(1S,3S,4R,6R)-bicyclo[4.2.1]non-7-ene-3,4-diol
CID 25136543
trans-(1S,2S)-2-methylcyclopropan-1-ol
CID 13410812
(3aR,5R,6S,7aS)-2,3,3a,4,5,6,7,7a-octahydro-1H-indene-5,6-diol
CID 130891181
(4S,5S)-tricyclo[6.2.1.02,7]undecane-4,5-diol
CID 166987475
4-propan-2-ylcyclopentane-1,2-diol
CID 20608687
(2S,3S,4aR,8aS)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-2,3-diol
CID 22215815
(1S,2S,4R,5R)-cyclohexane-1,2,3,4,5-pentol
CID 10964847
bicyclo[2.2.1]heptane-2,5,7-triol
CID 22290058
(4S,5S)-thiane-2,4,5-triol
CID 13309262

Frequently Asked Questions

What is the IUPAC name of trans-(1R,2R)-cyclopropane-1,2-diol?
The IUPAC name of trans-(1R,2R)-cyclopropane-1,2-diol (CID 59075452) is trans-(1R,2R)-cyclopropane-1,2-diol.
What is the SMILES notation for trans-(1R,2R)-cyclopropane-1,2-diol?
The canonical SMILES for trans-(1R,2R)-cyclopropane-1,2-diol is O[C@@H]1C[C@H]1O.
What is the InChIKey of trans-(1R,2R)-cyclopropane-1,2-diol?
The InChIKey is BTWIMZVCLMHNAV-PWNYCUMCSA-N. The full InChI is InChI=1S/C3H6O2/c4-2-1-3(2)5/h2-5H,1H2/t2-,3-/m1/s1.
What are the key properties of trans-(1R,2R)-cyclopropane-1,2-diol?
trans-(1R,2R)-cyclopropane-1,2-diol has a molecular weight of 74.08 g/mol, XLogP of -0.89, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1R,2R)-cyclopropane-1,2-diol is sourced from PubChem (CID 59075452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).