(1S,2R,6R,7R)-tricyclo[5.2.1.02,6]decan-2-ol

C10H16O — CID 13070372

IUPAC(1S,2R,6R,7R)-tricyclo[5.2.1.02,6]decan-2-ol
SMILESO[C@@]12CCC[C@@H]1[C@@H]1CC[C@H]2C1
InChIInChI=1S/C10H16O/c11-10-5-1-2-9(10)7-3-4-8(10)6-7/h7-9,11H,1-6H2/t7-,8+,9-,10-/m1/s1
InChIKeyLTSKVMDZRCMFCL-UTINFBMNSA-N
MW152.24 g/mol
LogP1.95
Rot. Bonds

About (1S,2R,6R,7R)-tricyclo[5.2.1.02,6]decan-2-ol

(1S,2R,6R,7R)-tricyclo[5.2.1.02,6]decan-2-ol (PubChem CID 13070372) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is (1S,2R,6R,7R)-tricyclo[5.2.1.02,6]decan-2-ol.

Molecular Properties

Compound Name(1S,2R,6R,7R)-tricyclo[5.2.1.02,6]decan-2-ol
PubChem CID13070372
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Name(1S,2R,6R,7R)-tricyclo[5.2.1.02,6]decan-2-ol
SMILESO[C@@]12CCC[C@@H]1[C@@H]1CC[C@H]2C1
InChIInChI=1S/C10H16O/c11-10-5-1-2-9(10)7-3-4-8(10)6-7/h7-9,11H,1-6H2/t7-,8+,9-,10-/m1/s1
InChIKeyLTSKVMDZRCMFCL-UTINFBMNSA-N
XLogP1.95
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (1S,2R,6R,7R)-tricyclo[5.2.1.02,6]decan-2-ol?
The IUPAC name of (1S,2R,6R,7R)-tricyclo[5.2.1.02,6]decan-2-ol (CID 13070372) is (1S,2R,6R,7R)-tricyclo[5.2.1.02,6]decan-2-ol.
What is the SMILES notation for (1S,2R,6R,7R)-tricyclo[5.2.1.02,6]decan-2-ol?
The canonical SMILES for (1S,2R,6R,7R)-tricyclo[5.2.1.02,6]decan-2-ol is O[C@@]12CCC[C@@H]1[C@@H]1CC[C@H]2C1.
What is the InChIKey of (1S,2R,6R,7R)-tricyclo[5.2.1.02,6]decan-2-ol?
The InChIKey is LTSKVMDZRCMFCL-UTINFBMNSA-N. The full InChI is InChI=1S/C10H16O/c11-10-5-1-2-9(10)7-3-4-8(10)6-7/h7-9,11H,1-6H2/t7-,8+,9-,10-/m1/s1.
What are the key properties of (1S,2R,6R,7R)-tricyclo[5.2.1.02,6]decan-2-ol?
(1S,2R,6R,7R)-tricyclo[5.2.1.02,6]decan-2-ol has a molecular weight of 152.24 g/mol, XLogP of 1.95, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,2R,6R,7R)-tricyclo[5.2.1.02,6]decan-2-ol is sourced from PubChem (CID 13070372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).