(2R,6S,10R,14S)-5,7,9,11-tetraoxatetracyclo[6.6.0.02,6.010,14]tetradecane

C10H14O4 — CID 139200718

IUPAC(2R,6S,10R,14S)-5,7,9,11-tetraoxatetracyclo[6.6.0.02,6.010,14]tetradecane
SMILESC1C[C@@H]2C3C(O[C@@H]2O1)O[C@H]1OCC[C@@H]31
InChIInChI=1S/C10H14O4/c1-3-11-8-5(1)7-6-2-4-12-9(6)14-10(7)13-8/h5-10H,1-4H2/t5-,6+,7?,8+,9-,10?
InChIKeyLFGXDFQOUJBSOV-AIHUYORHSA-N
MW198.22 g/mol
LogP0.71
Rot. Bonds

About (2R,6S,10R,14S)-5,7,9,11-tetraoxatetracyclo[6.6.0.02,6.010,14]tetradecane

(2R,6S,10R,14S)-5,7,9,11-tetraoxatetracyclo[6.6.0.02,6.010,14]tetradecane (PubChem CID 139200718) has the molecular formula C10H14O4 and a molecular weight of 198.22 g/mol. Its IUPAC name is (2R,6S,10R,14S)-5,7,9,11-tetraoxatetracyclo[6.6.0.02,6.010,14]tetradecane.

Molecular Properties

Compound Name(2R,6S,10R,14S)-5,7,9,11-tetraoxatetracyclo[6.6.0.02,6.010,14]tetradecane
PubChem CID139200718
Molecular FormulaC10H14O4
Molecular Weight198.22 g/mol
Exact Mass198.09
IUPAC Name(2R,6S,10R,14S)-5,7,9,11-tetraoxatetracyclo[6.6.0.02,6.010,14]tetradecane
SMILESC1C[C@@H]2C3C(O[C@@H]2O1)O[C@H]1OCC[C@@H]31
InChIInChI=1S/C10H14O4/c1-3-11-8-5(1)7-6-2-4-12-9(6)14-10(7)13-8/h5-10H,1-4H2/t5-,6+,7?,8+,9-,10?
InChIKeyLFGXDFQOUJBSOV-AIHUYORHSA-N
XLogP0.71
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.22
LogP ≤ 50.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (2R,6S,10R,14S)-5,7,9,11-tetraoxatetracyclo[6.6.0.02,6.010,14]tetradecane with MolForge

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Related Compounds

5,7,9-trioxatricyclo[6.3.0.02,6]undecan-3-amine
CID 123749123
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CID 130240779
(3aR,4S,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-amine
CID 97302678
(5R)-2,6-dioxabicyclo[3.1.0]hexane
CID 174637140
(4R,5R)-5-methoxy-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-ol
CID 130240888
(4R,6aR)-4-methyl-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan
CID 58779336
(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-ol;(3aR,4R,6aS)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-ol
CID 159842811
(3aR,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-ol
CID 124524160
(3aS,4R)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-ol
CID 69459334
(1S,2R,3S,4S,6R,7S,9R,11R)-8,10,12,13-tetraoxapentacyclo[5.5.1.02,6.03,11.04,9]tridecane
CID 15972728
(3aS,6aR)-4-methyl-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan;ethane
CID 144802403
(3aR,6aS)-4-methyl-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan;ethane
CID 144768058

Frequently Asked Questions

What is the IUPAC name of (2R,6S,10R,14S)-5,7,9,11-tetraoxatetracyclo[6.6.0.02,6.010,14]tetradecane?
The IUPAC name of (2R,6S,10R,14S)-5,7,9,11-tetraoxatetracyclo[6.6.0.02,6.010,14]tetradecane (CID 139200718) is (2R,6S,10R,14S)-5,7,9,11-tetraoxatetracyclo[6.6.0.02,6.010,14]tetradecane.
What is the SMILES notation for (2R,6S,10R,14S)-5,7,9,11-tetraoxatetracyclo[6.6.0.02,6.010,14]tetradecane?
The canonical SMILES for (2R,6S,10R,14S)-5,7,9,11-tetraoxatetracyclo[6.6.0.02,6.010,14]tetradecane is C1C[C@@H]2C3C(O[C@@H]2O1)O[C@H]1OCC[C@@H]31.
What is the InChIKey of (2R,6S,10R,14S)-5,7,9,11-tetraoxatetracyclo[6.6.0.02,6.010,14]tetradecane?
The InChIKey is LFGXDFQOUJBSOV-AIHUYORHSA-N. The full InChI is InChI=1S/C10H14O4/c1-3-11-8-5(1)7-6-2-4-12-9(6)14-10(7)13-8/h5-10H,1-4H2/t5-,6+,7?,8+,9-,10?.
What are the key properties of (2R,6S,10R,14S)-5,7,9,11-tetraoxatetracyclo[6.6.0.02,6.010,14]tetradecane?
(2R,6S,10R,14S)-5,7,9,11-tetraoxatetracyclo[6.6.0.02,6.010,14]tetradecane has a molecular weight of 198.22 g/mol, XLogP of 0.71, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,6S,10R,14S)-5,7,9,11-tetraoxatetracyclo[6.6.0.02,6.010,14]tetradecane is sourced from PubChem (CID 139200718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).