3-(2,2-dimethylpropyl)-4-methyl-2,3-dihydrofuran

C10H18O — CID 91304644

IUPAC3-(2,2-dimethylpropyl)-4-methyl-2,3-dihydrofuran
SMILESCC1=COCC1CC(C)(C)C
InChIInChI=1S/C10H18O/c1-8-6-11-7-9(8)5-10(2,3)4/h6,9H,5,7H2,1-4H3
InChIKeyNBOLELFCXIYTLN-UHFFFAOYSA-N
MW154.25 g/mol
LogP2.97
Rot. Bonds1

About 3-(2,2-dimethylpropyl)-4-methyl-2,3-dihydrofuran

3-(2,2-dimethylpropyl)-4-methyl-2,3-dihydrofuran (PubChem CID 91304644) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is 3-(2,2-dimethylpropyl)-4-methyl-2,3-dihydrofuran.

Molecular Properties

Compound Name3-(2,2-dimethylpropyl)-4-methyl-2,3-dihydrofuran
PubChem CID91304644
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name3-(2,2-dimethylpropyl)-4-methyl-2,3-dihydrofuran
SMILESCC1=COCC1CC(C)(C)C
InChIInChI=1S/C10H18O/c1-8-6-11-7-9(8)5-10(2,3)4/h6,9H,5,7H2,1-4H3
InChIKeyNBOLELFCXIYTLN-UHFFFAOYSA-N
XLogP2.97
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-Sec-butyl-2,3-dihydrofuran
CID 566088
4-Isobutyl-2,3-dihydrofuran
CID 141411171
(4S)-3,3-dimethyl-4-prop-1-en-2-yloxolane
CID 162397566
3,3-Dimethyl-4-prop-1-en-2-yloxolane
CID 176435358
1-Ethoxy-2,3,5,5-tetramethylhex-1-ene
CID 170842835
Furan, 2,3-dihydro-4-(1-methylpropyl)-, (S)-
CID 22215322
2-Methyl-4-propan-2-yl-2,3-dihydrofuran
CID 12218397
2,4-Ditert-butyl-2,3-dihydrofuran
CID 57754817
4-Tert-butyl-2,3-dihydrofuran
CID 58312085
3,4-Ditert-butyl-2,3-dihydrofuran
CID 58778250
4-Tert-butyl-2-ethyl-2,3-dihydrofuran
CID 68023934
3-ethyl-5-methyl-3,4-dihydro-2H-pyran
CID 86086100

Frequently Asked Questions

What is the IUPAC name of 3-(2,2-dimethylpropyl)-4-methyl-2,3-dihydrofuran?
The IUPAC name of 3-(2,2-dimethylpropyl)-4-methyl-2,3-dihydrofuran (CID 91304644) is 3-(2,2-dimethylpropyl)-4-methyl-2,3-dihydrofuran.
What is the SMILES notation for 3-(2,2-dimethylpropyl)-4-methyl-2,3-dihydrofuran?
The canonical SMILES for 3-(2,2-dimethylpropyl)-4-methyl-2,3-dihydrofuran is CC1=COCC1CC(C)(C)C.
What is the InChIKey of 3-(2,2-dimethylpropyl)-4-methyl-2,3-dihydrofuran?
The InChIKey is NBOLELFCXIYTLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O/c1-8-6-11-7-9(8)5-10(2,3)4/h6,9H,5,7H2,1-4H3.
What are the key properties of 3-(2,2-dimethylpropyl)-4-methyl-2,3-dihydrofuran?
3-(2,2-dimethylpropyl)-4-methyl-2,3-dihydrofuran has a molecular weight of 154.25 g/mol, XLogP of 2.97, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,2-dimethylpropyl)-4-methyl-2,3-dihydrofuran is sourced from PubChem (CID 91304644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).