(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-(2,4,6-trimethylphenyl)methanone

C19H20O2 — CID 43297079

IUPAC(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-(2,4,6-trimethylphenyl)methanone
SMILESCc1cc(C)c(C(=O)c2ccc3c(c2)CC(C)O3)c(C)c1
InChIInChI=1S/C19H20O2/c1-11-7-12(2)18(13(3)8-11)19(20)15-5-6-17-16(10-15)9-14(4)21-17/h5-8,10,14H,9H2,1-4H3
InChIKeyMXJMAFIWXNPFJX-UHFFFAOYSA-N
MW280.37 g/mol
LogP4.17
Rot. Bonds2

About (2-methyl-2,3-dihydro-1-benzofuran-5-yl)-(2,4,6-trimethylphenyl)methanone

(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-(2,4,6-trimethylphenyl)methanone (PubChem CID 43297079) has the molecular formula C19H20O2 and a molecular weight of 280.37 g/mol. Its IUPAC name is (2-methyl-2,3-dihydro-1-benzofuran-5-yl)-(2,4,6-trimethylphenyl)methanone.

Molecular Properties

Compound Name(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-(2,4,6-trimethylphenyl)methanone
PubChem CID43297079
Molecular FormulaC19H20O2
Molecular Weight280.37 g/mol
Exact Mass280.15
IUPAC Name(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-(2,4,6-trimethylphenyl)methanone
SMILESCc1cc(C)c(C(=O)c2ccc3c(c2)CC(C)O3)c(C)c1
InChIInChI=1S/C19H20O2/c1-11-7-12(2)18(13(3)8-11)19(20)15-5-6-17-16(10-15)9-14(4)21-17/h5-8,10,14H,9H2,1-4H3
InChIKeyMXJMAFIWXNPFJX-UHFFFAOYSA-N
XLogP4.17
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 54.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2-methyl-2,3-dihydro-1-benzofuran-5-yl)-(2,4,6-trimethylphenyl)methanone?
The IUPAC name of (2-methyl-2,3-dihydro-1-benzofuran-5-yl)-(2,4,6-trimethylphenyl)methanone (CID 43297079) is (2-methyl-2,3-dihydro-1-benzofuran-5-yl)-(2,4,6-trimethylphenyl)methanone.
What is the SMILES notation for (2-methyl-2,3-dihydro-1-benzofuran-5-yl)-(2,4,6-trimethylphenyl)methanone?
The canonical SMILES for (2-methyl-2,3-dihydro-1-benzofuran-5-yl)-(2,4,6-trimethylphenyl)methanone is Cc1cc(C)c(C(=O)c2ccc3c(c2)CC(C)O3)c(C)c1.
What is the InChIKey of (2-methyl-2,3-dihydro-1-benzofuran-5-yl)-(2,4,6-trimethylphenyl)methanone?
The InChIKey is MXJMAFIWXNPFJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20O2/c1-11-7-12(2)18(13(3)8-11)19(20)15-5-6-17-16(10-15)9-14(4)21-17/h5-8,10,14H,9H2,1-4H3.
What are the key properties of (2-methyl-2,3-dihydro-1-benzofuran-5-yl)-(2,4,6-trimethylphenyl)methanone?
(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-(2,4,6-trimethylphenyl)methanone has a molecular weight of 280.37 g/mol, XLogP of 4.17, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methyl-2,3-dihydro-1-benzofuran-5-yl)-(2,4,6-trimethylphenyl)methanone is sourced from PubChem (CID 43297079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).