4,4a,5,7-tetrahydrofuro[3,4-f][2]benzofuran

C10H10O2 — CID 141342863

IUPAC4,4a,5,7-tetrahydrofuro[3,4-f][2]benzofuran
SMILESC1=C2COCC2Cc2cocc21
InChIInChI=1S/C10H10O2/c1-7-3-11-5-9(7)2-10-6-12-4-8(1)10/h1,3,5,10H,2,4,6H2
InChIKeyPYTRHWYYXSUPHS-UHFFFAOYSA-N
MW162.19 g/mol
LogP1.87
Rot. Bonds

About 4,4a,5,7-tetrahydrofuro[3,4-f][2]benzofuran

4,4a,5,7-tetrahydrofuro[3,4-f][2]benzofuran (PubChem CID 141342863) has the molecular formula C10H10O2 and a molecular weight of 162.19 g/mol. Its IUPAC name is 4,4a,5,7-tetrahydrofuro[3,4-f][2]benzofuran.

Molecular Properties

Compound Name4,4a,5,7-tetrahydrofuro[3,4-f][2]benzofuran
PubChem CID141342863
Molecular FormulaC10H10O2
Molecular Weight162.19 g/mol
Exact Mass162.07
IUPAC Name4,4a,5,7-tetrahydrofuro[3,4-f][2]benzofuran
SMILESC1=C2COCC2Cc2cocc21
InChIInChI=1S/C10H10O2/c1-7-3-11-5-9(7)2-10-6-12-4-8(1)10/h1,3,5,10H,2,4,6H2
InChIKeyPYTRHWYYXSUPHS-UHFFFAOYSA-N
XLogP1.87
TPSA22.37 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.19
LogP ≤ 51.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4,4a,5,7-tetrahydrofuro[3,4-f][2]benzofuran with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1,3,3a,4-tetrahydro-2-benzofuran
CID 22708525
3,6,7,7a-tetrahydro-1H-furo[3,4-c]pyran
CID 91539474
(3aS,5aR)-1,3,3a,4,5,5a,6,8-octahydrofuro[3,4-e][2]benzofuran
CID 102089093
9-benzyl-3-(oxetan-3-yl)-9-azabicyclo[3.3.1]non-2-ene
CID 171974612
3-oxa-11-azatricyclo[7.4.1.05,14]tetradeca-5,7,9(14)-triene
CID 161012551
(4S)-4-benzyl-3,4,5,6-tetrahydro-1H-2,5-benzoxazocine
CID 97102714
3-(4-bromofuran-3-yl)oxane
CID 82390776
7-methyl-3-oxa-7-azatricyclo[7.3.1.05,13]trideca-1(12),9(13),10-trien-11-amine
CID 167309053
6-methyl-1,3,3a,6-tetrahydro-2-benzofuran
CID 23624501
(3aR)-6-methyl-1,3,3a,6-tetrahydro-2-benzofuran
CID 132991139
(5S)-5-aminooxan-3-one
CID 129203799
5-methyl-3,6-dihydro-2H-pyran-3-ol
CID 143495144

Frequently Asked Questions

What is the IUPAC name of 4,4a,5,7-tetrahydrofuro[3,4-f][2]benzofuran?
The IUPAC name of 4,4a,5,7-tetrahydrofuro[3,4-f][2]benzofuran (CID 141342863) is 4,4a,5,7-tetrahydrofuro[3,4-f][2]benzofuran.
What is the SMILES notation for 4,4a,5,7-tetrahydrofuro[3,4-f][2]benzofuran?
The canonical SMILES for 4,4a,5,7-tetrahydrofuro[3,4-f][2]benzofuran is C1=C2COCC2Cc2cocc21.
What is the InChIKey of 4,4a,5,7-tetrahydrofuro[3,4-f][2]benzofuran?
The InChIKey is PYTRHWYYXSUPHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10O2/c1-7-3-11-5-9(7)2-10-6-12-4-8(1)10/h1,3,5,10H,2,4,6H2.
What are the key properties of 4,4a,5,7-tetrahydrofuro[3,4-f][2]benzofuran?
4,4a,5,7-tetrahydrofuro[3,4-f][2]benzofuran has a molecular weight of 162.19 g/mol, XLogP of 1.87, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4a,5,7-tetrahydrofuro[3,4-f][2]benzofuran is sourced from PubChem (CID 141342863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).