2-methyl-5-[(2S)-3-methylbutan-2-yl]furan

C10H16O — CID 59302907

IUPAC2-methyl-5-[(2S)-3-methylbutan-2-yl]furan
SMILESCc1ccc([C@@H](C)C(C)C)o1
InChIInChI=1S/C10H16O/c1-7(2)9(4)10-6-5-8(3)11-10/h5-7,9H,1-4H3/t9-/m0/s1
InChIKeyWRPRUMKDYSXSJT-VIFPVBQESA-N
MW152.24 g/mol
LogP3.35
Rot. Bonds2

About 2-methyl-5-[(2S)-3-methylbutan-2-yl]furan

2-methyl-5-[(2S)-3-methylbutan-2-yl]furan (PubChem CID 59302907) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is 2-methyl-5-[(2S)-3-methylbutan-2-yl]furan.

Molecular Properties

Compound Name2-methyl-5-[(2S)-3-methylbutan-2-yl]furan
PubChem CID59302907
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Name2-methyl-5-[(2S)-3-methylbutan-2-yl]furan
SMILESCc1ccc([C@@H](C)C(C)C)o1
InChIInChI=1S/C10H16O/c1-7(2)9(4)10-6-5-8(3)11-10/h5-7,9H,1-4H3/t9-/m0/s1
InChIKeyWRPRUMKDYSXSJT-VIFPVBQESA-N
XLogP3.35
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-[(2S)-3-methylbutan-2-yl]furan?
The IUPAC name of 2-methyl-5-[(2S)-3-methylbutan-2-yl]furan (CID 59302907) is 2-methyl-5-[(2S)-3-methylbutan-2-yl]furan.
What is the SMILES notation for 2-methyl-5-[(2S)-3-methylbutan-2-yl]furan?
The canonical SMILES for 2-methyl-5-[(2S)-3-methylbutan-2-yl]furan is Cc1ccc([C@@H](C)C(C)C)o1.
What is the InChIKey of 2-methyl-5-[(2S)-3-methylbutan-2-yl]furan?
The InChIKey is WRPRUMKDYSXSJT-VIFPVBQESA-N. The full InChI is InChI=1S/C10H16O/c1-7(2)9(4)10-6-5-8(3)11-10/h5-7,9H,1-4H3/t9-/m0/s1.
What are the key properties of 2-methyl-5-[(2S)-3-methylbutan-2-yl]furan?
2-methyl-5-[(2S)-3-methylbutan-2-yl]furan has a molecular weight of 152.24 g/mol, XLogP of 3.35, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-[(2S)-3-methylbutan-2-yl]furan is sourced from PubChem (CID 59302907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).