(3aS,4R,6aR)-4-cyclobutyloxy-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan

C10H16O3 — CID 163910669

IUPAC(3aS,4R,6aR)-4-cyclobutyloxy-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan
SMILESC1CC(O[C@H]2CO[C@H]3OCC[C@H]32)C1
InChIInChI=1S/C10H16O3/c1-2-7(3-1)13-9-6-12-10-8(9)4-5-11-10/h7-10H,1-6H2/t8-,9-,10+/m0/s1
InChIKeyQRUIJXOHHOSLDU-LPEHRKFASA-N
MW184.23 g/mol
LogP1.32
Rot. Bonds2

About (3aS,4R,6aR)-4-cyclobutyloxy-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan

(3aS,4R,6aR)-4-cyclobutyloxy-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan (PubChem CID 163910669) has the molecular formula C10H16O3 and a molecular weight of 184.23 g/mol. Its IUPAC name is (3aS,4R,6aR)-4-cyclobutyloxy-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan.

Molecular Properties

Compound Name(3aS,4R,6aR)-4-cyclobutyloxy-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan
PubChem CID163910669
Molecular FormulaC10H16O3
Molecular Weight184.23 g/mol
Exact Mass184.11
IUPAC Name(3aS,4R,6aR)-4-cyclobutyloxy-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan
SMILESC1CC(O[C@H]2CO[C@H]3OCC[C@H]32)C1
InChIInChI=1S/C10H16O3/c1-2-7(3-1)13-9-6-12-10-8(9)4-5-11-10/h7-10H,1-6H2/t8-,9-,10+/m0/s1
InChIKeyQRUIJXOHHOSLDU-LPEHRKFASA-N
XLogP1.32
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.23
LogP ≤ 51.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze (3aS,4R,6aR)-4-cyclobutyloxy-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan with MolForge

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Launch Full Analysis

Related Compounds

O-(2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl)hydroxylamine
CID 123959878
[(4R)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] formate
CID 59512802
(4R,6aR)-4-methyl-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan
CID 58779336
(3aR,6aS)-4-methyl-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan;ethane
CID 144768058
(3aS,6aR)-4-methyl-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan;ethane
CID 144802403
(3aR,6aR)-4-methyl-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan;ethane
CID 144768068
cyclobutyloxycyclobutane;hydrofluoride
CID 174842144
3-[[4-[[(3aS,4S,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl]oxy]cyclohexyl]amino]-5-(3,3-dimethylbut-1-ynyl)thiophene-2-carboxylic acid
CID 70805153
(3aR,4S,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-amine
CID 97302678
(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

Frequently Asked Questions

What is the IUPAC name of (3aS,4R,6aR)-4-cyclobutyloxy-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan?
The IUPAC name of (3aS,4R,6aR)-4-cyclobutyloxy-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan (CID 163910669) is (3aS,4R,6aR)-4-cyclobutyloxy-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan.
What is the SMILES notation for (3aS,4R,6aR)-4-cyclobutyloxy-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan?
The canonical SMILES for (3aS,4R,6aR)-4-cyclobutyloxy-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan is C1CC(O[C@H]2CO[C@H]3OCC[C@H]32)C1.
What is the InChIKey of (3aS,4R,6aR)-4-cyclobutyloxy-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan?
The InChIKey is QRUIJXOHHOSLDU-LPEHRKFASA-N. The full InChI is InChI=1S/C10H16O3/c1-2-7(3-1)13-9-6-12-10-8(9)4-5-11-10/h7-10H,1-6H2/t8-,9-,10+/m0/s1.
What are the key properties of (3aS,4R,6aR)-4-cyclobutyloxy-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan?
(3aS,4R,6aR)-4-cyclobutyloxy-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan has a molecular weight of 184.23 g/mol, XLogP of 1.32, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3aS,4R,6aR)-4-cyclobutyloxy-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan is sourced from PubChem (CID 163910669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).