(2R,4S)-4-trimethylstannyladamantan-2-ol

C13H24OSn — CID 13131422

IUPAC(2R,4S)-4-trimethylstannyladamantan-2-ol
SMILESC[Sn](C)(C)[C@H]1C2CC3CC(C2)[C@@H](O)C1C3
InChIInChI=1S/C10H15O.3CH3.Sn/c11-10-8-2-6-1-7(4-8)5-9(10)3-6;;;;/h2,6-11H,1,3-5H2;3*1H3;/t6?,7?,8?,9?,10-;;;;/m0..../s1
InChIKeyARYCFOTZPADEAW-QEIQACPYSA-N
MW315.05 g/mol
LogP3.12
Rot. Bonds1

About (2R,4S)-4-trimethylstannyladamantan-2-ol

(2R,4S)-4-trimethylstannyladamantan-2-ol (PubChem CID 13131422) has the molecular formula C13H24OSn and a molecular weight of 315.05 g/mol. Its IUPAC name is (2R,4S)-4-trimethylstannyladamantan-2-ol.

Molecular Properties

Compound Name(2R,4S)-4-trimethylstannyladamantan-2-ol
PubChem CID13131422
Molecular FormulaC13H24OSn
Molecular Weight315.05 g/mol
Exact Mass316.08
IUPAC Name(2R,4S)-4-trimethylstannyladamantan-2-ol
SMILESC[Sn](C)(C)[C@H]1C2CC3CC(C2)[C@@H](O)C1C3
InChIInChI=1S/C10H15O.3CH3.Sn/c11-10-8-2-6-1-7(4-8)5-9(10)3-6;;;;/h2,6-11H,1,3-5H2;3*1H3;/t6?,7?,8?,9?,10-;;;;/m0..../s1
InChIKeyARYCFOTZPADEAW-QEIQACPYSA-N
XLogP3.12
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.05
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-methyladamantan-2-ol
CID 590471
(2R,4S)-4-trimethylsilyladamantan-2-ol
CID 13131354
(1S,2R,3S,4S,5S,7S)-4-hydroxyadamantane-2-carboxylic acid
CID 100872241
adamantane-2,4-diol;propan-2-yl formate
CID 175207734
trimethyl(3-tricyclo[2.2.1.02,6]heptanyl)stannane
CID 12678484
(3R,4S)-tricyclo[4.2.1.03,7]nonan-4-ol
CID 12649513
(1S,2R,3R,4S,5R,7S)-4-(3-hydroxyphenyl)adamantan-2-ol
CID 45102252
1-[(1S,2S,3R,5R,7S)-2-tricyclo[3.3.1.03,7]nonanyl]ethanone
CID 129429042
2-methyladamantane-1,4-diol
CID 150043877
ethane;pentacyclo[7.3.1.14,12.02,7.06,11]tetradecane
CID 91434011
2,4-difluoroadamantane
CID 13186696
adamantane-2,4-diamine
CID 12813520

Frequently Asked Questions

What is the IUPAC name of (2R,4S)-4-trimethylstannyladamantan-2-ol?
The IUPAC name of (2R,4S)-4-trimethylstannyladamantan-2-ol (CID 13131422) is (2R,4S)-4-trimethylstannyladamantan-2-ol.
What is the SMILES notation for (2R,4S)-4-trimethylstannyladamantan-2-ol?
The canonical SMILES for (2R,4S)-4-trimethylstannyladamantan-2-ol is C[Sn](C)(C)[C@H]1C2CC3CC(C2)[C@@H](O)C1C3.
What is the InChIKey of (2R,4S)-4-trimethylstannyladamantan-2-ol?
The InChIKey is ARYCFOTZPADEAW-QEIQACPYSA-N. The full InChI is InChI=1S/C10H15O.3CH3.Sn/c11-10-8-2-6-1-7(4-8)5-9(10)3-6;;;;/h2,6-11H,1,3-5H2;3*1H3;/t6?,7?,8?,9?,10-;;;;/m0..../s1.
What are the key properties of (2R,4S)-4-trimethylstannyladamantan-2-ol?
(2R,4S)-4-trimethylstannyladamantan-2-ol has a molecular weight of 315.05 g/mol, XLogP of 3.12, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,4S)-4-trimethylstannyladamantan-2-ol is sourced from PubChem (CID 13131422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).