(1R,2R,6S,8S,10S)-5,5,11,11-tetramethyltetracyclo[6.2.1.01,6.06,10]undecan-2-ol

C15H24O — CID 7074697

IUPAC(1R,2R,6S,8S,10S)-5,5,11,11-tetramethyltetracyclo[6.2.1.01,6.06,10]undecan-2-ol
SMILESCC1(C)[C@H]2C[C@@H]3[C@@]14[C@H](O)CCC(C)(C)[C@]34C2
InChIInChI=1S/C15H24O/c1-12(2)6-5-11(16)15-10-7-9(13(15,3)4)8-14(10,12)15/h9-11,16H,5-8H2,1-4H3/t9-,10-,11+,14-,15+/m0/s1
InChIKeyURRFLKHHGNPGCX-VOAKKNSGSA-N
MW220.36 g/mol
LogP3.22
Rot. Bonds

About (1R,2R,6S,8S,10S)-5,5,11,11-tetramethyltetracyclo[6.2.1.01,6.06,10]undecan-2-ol

(1R,2R,6S,8S,10S)-5,5,11,11-tetramethyltetracyclo[6.2.1.01,6.06,10]undecan-2-ol (PubChem CID 7074697) has the molecular formula C15H24O and a molecular weight of 220.36 g/mol. Its IUPAC name is (1R,2R,6S,8S,10S)-5,5,11,11-tetramethyltetracyclo[6.2.1.01,6.06,10]undecan-2-ol.

Molecular Properties

Compound Name(1R,2R,6S,8S,10S)-5,5,11,11-tetramethyltetracyclo[6.2.1.01,6.06,10]undecan-2-ol
PubChem CID7074697
Molecular FormulaC15H24O
Molecular Weight220.36 g/mol
Exact Mass220.18
IUPAC Name(1R,2R,6S,8S,10S)-5,5,11,11-tetramethyltetracyclo[6.2.1.01,6.06,10]undecan-2-ol
SMILESCC1(C)[C@H]2C[C@@H]3[C@@]14[C@H](O)CCC(C)(C)[C@]34C2
InChIInChI=1S/C15H24O/c1-12(2)6-5-11(16)15-10-7-9(13(15,3)4)8-14(10,12)15/h9-11,16H,5-8H2,1-4H3/t9-,10-,11+,14-,15+/m0/s1
InChIKeyURRFLKHHGNPGCX-VOAKKNSGSA-N
XLogP3.22
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (1R,2R,6S,8S,10S)-5,5,11,11-tetramethyltetracyclo[6.2.1.01,6.06,10]undecan-2-ol?
The IUPAC name of (1R,2R,6S,8S,10S)-5,5,11,11-tetramethyltetracyclo[6.2.1.01,6.06,10]undecan-2-ol (CID 7074697) is (1R,2R,6S,8S,10S)-5,5,11,11-tetramethyltetracyclo[6.2.1.01,6.06,10]undecan-2-ol.
What is the SMILES notation for (1R,2R,6S,8S,10S)-5,5,11,11-tetramethyltetracyclo[6.2.1.01,6.06,10]undecan-2-ol?
The canonical SMILES for (1R,2R,6S,8S,10S)-5,5,11,11-tetramethyltetracyclo[6.2.1.01,6.06,10]undecan-2-ol is CC1(C)[C@H]2C[C@@H]3[C@@]14[C@H](O)CCC(C)(C)[C@]34C2.
What is the InChIKey of (1R,2R,6S,8S,10S)-5,5,11,11-tetramethyltetracyclo[6.2.1.01,6.06,10]undecan-2-ol?
The InChIKey is URRFLKHHGNPGCX-VOAKKNSGSA-N. The full InChI is InChI=1S/C15H24O/c1-12(2)6-5-11(16)15-10-7-9(13(15,3)4)8-14(10,12)15/h9-11,16H,5-8H2,1-4H3/t9-,10-,11+,14-,15+/m0/s1.
What are the key properties of (1R,2R,6S,8S,10S)-5,5,11,11-tetramethyltetracyclo[6.2.1.01,6.06,10]undecan-2-ol?
(1R,2R,6S,8S,10S)-5,5,11,11-tetramethyltetracyclo[6.2.1.01,6.06,10]undecan-2-ol has a molecular weight of 220.36 g/mol, XLogP of 3.22, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,2R,6S,8S,10S)-5,5,11,11-tetramethyltetracyclo[6.2.1.01,6.06,10]undecan-2-ol is sourced from PubChem (CID 7074697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).