(4R)-tricyclo[5.2.1.02,6]decane-3,4-diol

C10H16O2 — CID 166987336

IUPAC(4R)-tricyclo[5.2.1.02,6]decane-3,4-diol
SMILESOC1C2C3CCC(C3)C2C[C@H]1O
InChIInChI=1S/C10H16O2/c11-8-4-7-5-1-2-6(3-5)9(7)10(8)12/h5-12H,1-4H2/t5?,6?,7?,8-,9?,10?/m1/s1
InChIKeyXZDKBXDSOIMBNM-VUHGIHLKSA-N
MW168.24 g/mol
LogP0.77
Rot. Bonds

About (4R)-tricyclo[5.2.1.02,6]decane-3,4-diol

(4R)-tricyclo[5.2.1.02,6]decane-3,4-diol (PubChem CID 166987336) has the molecular formula C10H16O2 and a molecular weight of 168.24 g/mol. Its IUPAC name is (4R)-tricyclo[5.2.1.02,6]decane-3,4-diol.

Molecular Properties

Compound Name(4R)-tricyclo[5.2.1.02,6]decane-3,4-diol
PubChem CID166987336
Molecular FormulaC10H16O2
Molecular Weight168.24 g/mol
Exact Mass168.12
IUPAC Name(4R)-tricyclo[5.2.1.02,6]decane-3,4-diol
SMILESOC1C2C3CCC(C3)C2C[C@H]1O
InChIInChI=1S/C10H16O2/c11-8-4-7-5-1-2-6(3-5)9(7)10(8)12/h5-12H,1-4H2/t5?,6?,7?,8-,9?,10?/m1/s1
InChIKeyXZDKBXDSOIMBNM-VUHGIHLKSA-N
XLogP0.77
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 50.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (4R)-tricyclo[5.2.1.02,6]decane-3,4-diol with MolForge

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Related Compounds

Octahydro-4,7-methano-1H-indene-1,2-diol
CID 98964
Octahydro-4,7-methano-1H-inden-5-ol
CID 95606
8-Hydroxy-4-hydroxymethyltricyclo(5.2.1.0 2,6)decane
CID 253824
4,7-Methano-1H-inden-1-ol, octahydro-
CID 548785
rac-(1R,2R,3R,6S,7S)-tricyclo[5.2.1.0,2,6]decan-3-ol
CID 12910441
Tricyclo[5.2.1.0 (2,6)]decan-10-ol
CID 578081
Octahydro-4,7-methano-1H-indene-5,6-diol
CID 44153885
(1alpha,3Abeta,4beta,7beta,7abeta)-octahydro-4,7-methano-1H-inden-1-ol
CID 112097
rac-(1R,2R,6S,7S)-tricyclo(5.2.1.0,2,6)decan-3-ol
CID 155821960
Exo,exo-4-methyl-octahydro-4,7-methanoindene-5,6-diol
CID 70126233
Octahydro-4,7-methano-1H-indenetriol
CID 6453893
4,7-Methanoindan-5-ol, hexahydro-, endo-,exo-
CID 13191203

Frequently Asked Questions

What is the IUPAC name of (4R)-tricyclo[5.2.1.02,6]decane-3,4-diol?
The IUPAC name of (4R)-tricyclo[5.2.1.02,6]decane-3,4-diol (CID 166987336) is (4R)-tricyclo[5.2.1.02,6]decane-3,4-diol.
What is the SMILES notation for (4R)-tricyclo[5.2.1.02,6]decane-3,4-diol?
The canonical SMILES for (4R)-tricyclo[5.2.1.02,6]decane-3,4-diol is OC1C2C3CCC(C3)C2C[C@H]1O.
What is the InChIKey of (4R)-tricyclo[5.2.1.02,6]decane-3,4-diol?
The InChIKey is XZDKBXDSOIMBNM-VUHGIHLKSA-N. The full InChI is InChI=1S/C10H16O2/c11-8-4-7-5-1-2-6(3-5)9(7)10(8)12/h5-12H,1-4H2/t5?,6?,7?,8-,9?,10?/m1/s1.
What are the key properties of (4R)-tricyclo[5.2.1.02,6]decane-3,4-diol?
(4R)-tricyclo[5.2.1.02,6]decane-3,4-diol has a molecular weight of 168.24 g/mol, XLogP of 0.77, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-tricyclo[5.2.1.02,6]decane-3,4-diol is sourced from PubChem (CID 166987336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).