2,4-dimethyl-6-propan-2-yl-6,7-dihydro-5H-1-benzofuran-4-ol;2-methylpropane

C17H30O2 — CID 155577682

IUPAC2,4-dimethyl-6-propan-2-yl-6,7-dihydro-5H-1-benzofuran-4-ol;2-methylpropane
SMILESCC(C)C.Cc1cc2c(o1)CC(C(C)C)CC2(C)O
InChIInChI=1S/C13H20O2.C4H10/c1-8(2)10-6-12-11(5-9(3)15-12)13(4,14)7-10;1-4(2)3/h5,8,10,14H,6-7H2,1-4H3;4H,1-3H3
InChIKeyHWZALSVCTXAXIU-UHFFFAOYSA-N
MW266.43 g/mol
LogP4.68
Rot. Bonds1

About 2,4-dimethyl-6-propan-2-yl-6,7-dihydro-5H-1-benzofuran-4-ol;2-methylpropane

2,4-dimethyl-6-propan-2-yl-6,7-dihydro-5H-1-benzofuran-4-ol;2-methylpropane (PubChem CID 155577682) has the molecular formula C17H30O2 and a molecular weight of 266.43 g/mol. Its IUPAC name is 2,4-dimethyl-6-propan-2-yl-6,7-dihydro-5H-1-benzofuran-4-ol;2-methylpropane.

Molecular Properties

Compound Name2,4-dimethyl-6-propan-2-yl-6,7-dihydro-5H-1-benzofuran-4-ol;2-methylpropane
PubChem CID155577682
Molecular FormulaC17H30O2
Molecular Weight266.43 g/mol
Exact Mass266.22
IUPAC Name2,4-dimethyl-6-propan-2-yl-6,7-dihydro-5H-1-benzofuran-4-ol;2-methylpropane
SMILESCC(C)C.Cc1cc2c(o1)CC(C(C)C)CC2(C)O
InChIInChI=1S/C13H20O2.C4H10/c1-8(2)10-6-12-11(5-9(3)15-12)13(4,14)7-10;1-4(2)3/h5,8,10,14H,6-7H2,1-4H3;4H,1-3H3
InChIKeyHWZALSVCTXAXIU-UHFFFAOYSA-N
XLogP4.68
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 54.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2,4-dimethyl-6-propan-2-yl-6,7-dihydro-5H-1-benzofuran-4-ol;2-methylpropane with MolForge

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Related Compounds

(5S)-1,2-dimethyl-5-propan-2-ylcyclohex-2-en-1-ol
CID 45096401
6-(difluoromethyl)-2-methyl-6,7-dihydro-5H-1-benzofuran-4-one
CID 102568117
2-(4-hydroxy-2,5-dimethyl-5,6-dihydrocyclopenta[b]furan-4-yl)acetic acid
CID 112716453
(1S)-1,6-dimethyl-4-propan-2-yl-3,4-dihydro-2H-naphthalen-1-ol
CID 91747482
1-(4-methoxy-2,5-dimethylphenyl)-3-propan-2-ylcyclobutan-1-ol
CID 103564078
4-(1-aminopropyl)-2-methyl-5,6-dihydrocyclopenta[b]furan-4-ol
CID 82400260
1-(2,5-dichlorophenyl)-3-propan-2-ylcyclobutan-1-ol
CID 103564302
1-(4-fluoro-2-methylphenyl)-4-propan-2-ylcyclohexan-1-ol
CID 63407272
1-[(3,4-dimethylphenyl)methyl]-4-propan-2-ylcyclohexan-1-ol
CID 63407188
1-(1-benzofuran-2-yl)-3-propan-2-ylcyclobutan-1-ol
CID 103564279
1-(4-methylphenyl)-4-propan-2-ylcyclohexan-1-ol
CID 63406811
1-(2,3-dimethylphenyl)-4-propan-2-ylcyclohexan-1-ol
CID 63406978

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-6-propan-2-yl-6,7-dihydro-5H-1-benzofuran-4-ol;2-methylpropane?
The IUPAC name of 2,4-dimethyl-6-propan-2-yl-6,7-dihydro-5H-1-benzofuran-4-ol;2-methylpropane (CID 155577682) is 2,4-dimethyl-6-propan-2-yl-6,7-dihydro-5H-1-benzofuran-4-ol;2-methylpropane.
What is the SMILES notation for 2,4-dimethyl-6-propan-2-yl-6,7-dihydro-5H-1-benzofuran-4-ol;2-methylpropane?
The canonical SMILES for 2,4-dimethyl-6-propan-2-yl-6,7-dihydro-5H-1-benzofuran-4-ol;2-methylpropane is CC(C)C.Cc1cc2c(o1)CC(C(C)C)CC2(C)O.
What is the InChIKey of 2,4-dimethyl-6-propan-2-yl-6,7-dihydro-5H-1-benzofuran-4-ol;2-methylpropane?
The InChIKey is HWZALSVCTXAXIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20O2.C4H10/c1-8(2)10-6-12-11(5-9(3)15-12)13(4,14)7-10;1-4(2)3/h5,8,10,14H,6-7H2,1-4H3;4H,1-3H3.
What are the key properties of 2,4-dimethyl-6-propan-2-yl-6,7-dihydro-5H-1-benzofuran-4-ol;2-methylpropane?
2,4-dimethyl-6-propan-2-yl-6,7-dihydro-5H-1-benzofuran-4-ol;2-methylpropane has a molecular weight of 266.43 g/mol, XLogP of 4.68, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-6-propan-2-yl-6,7-dihydro-5H-1-benzofuran-4-ol;2-methylpropane is sourced from PubChem (CID 155577682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).