6-methyl-3,6-dihydro-2H-cyclohepta[b]furan

C10H12O — CID 142161811

IUPAC6-methyl-3,6-dihydro-2H-cyclohepta[b]furan
SMILESCC1C=CC2=C(C=C1)OCC2
InChIInChI=1S/C10H12O/c1-8-2-4-9-6-7-11-10(9)5-3-8/h2-5,8H,6-7H2,1H3
InChIKeyYPTQVTQLVQMLGI-UHFFFAOYSA-N
MW148.20 g/mol
LogP2.42
Rot. Bonds

About 6-methyl-3,6-dihydro-2H-cyclohepta[b]furan

6-methyl-3,6-dihydro-2H-cyclohepta[b]furan (PubChem CID 142161811) has the molecular formula C10H12O and a molecular weight of 148.20 g/mol. Its IUPAC name is 6-methyl-3,6-dihydro-2H-cyclohepta[b]furan.

Molecular Properties

Compound Name6-methyl-3,6-dihydro-2H-cyclohepta[b]furan
PubChem CID142161811
Molecular FormulaC10H12O
Molecular Weight148.20 g/mol
Exact Mass148.09
IUPAC Name6-methyl-3,6-dihydro-2H-cyclohepta[b]furan
SMILESCC1C=CC2=C(C=C1)OCC2
InChIInChI=1S/C10H12O/c1-8-2-4-9-6-7-11-10(9)5-3-8/h2-5,8H,6-7H2,1H3
InChIKeyYPTQVTQLVQMLGI-UHFFFAOYSA-N
XLogP2.42
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.20
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 6-methyl-3,6-dihydro-2H-cyclohepta[b]furan 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

2H-Cyclohepta[b]furan
CID 71358872
7,8-Dihydrochromene
CID 143029736
8-fluoro-5-methyl-3,5-dihydro-2H-chromene
CID 90092815
6-fluoro-3,5-dihydro-2H-cyclohepta[b]furan
CID 135128534
2,2-Difluoro-3,6-dihydrocyclohepta[b]furan;ethane
CID 142270016
3,3-Difluoro-2,5-dihydrocyclohepta[b]furan;methane
CID 178110962
1H-Cyclohepta[c]furan
CID 71358935
2,4-dimethyl-4aH-cyclohepta[b][1]benzofuran
CID 91102715
[(8aS)-3,8a-dihydro-1H-cyclohepta[c]furan-6-yl] acetate
CID 102129899
7-Oxabenzonorcaradiene
CID 129868381
lithium (3S)-3,6-dimethyl-3,5-dihydro-2H-1-benzofuran-5-ide
CID 134943604
Benzo[6,7]cyclohepta[1,2-b]furan
CID 168433968

Frequently Asked Questions

What is the IUPAC name of 6-methyl-3,6-dihydro-2H-cyclohepta[b]furan?
The IUPAC name of 6-methyl-3,6-dihydro-2H-cyclohepta[b]furan (CID 142161811) is 6-methyl-3,6-dihydro-2H-cyclohepta[b]furan.
What is the SMILES notation for 6-methyl-3,6-dihydro-2H-cyclohepta[b]furan?
The canonical SMILES for 6-methyl-3,6-dihydro-2H-cyclohepta[b]furan is CC1C=CC2=C(C=C1)OCC2.
What is the InChIKey of 6-methyl-3,6-dihydro-2H-cyclohepta[b]furan?
The InChIKey is YPTQVTQLVQMLGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12O/c1-8-2-4-9-6-7-11-10(9)5-3-8/h2-5,8H,6-7H2,1H3.
What are the key properties of 6-methyl-3,6-dihydro-2H-cyclohepta[b]furan?
6-methyl-3,6-dihydro-2H-cyclohepta[b]furan has a molecular weight of 148.20 g/mol, XLogP of 2.42, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3,6-dihydro-2H-cyclohepta[b]furan is sourced from PubChem (CID 142161811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).