[(2R)-2,3-dihydro-1-benzofuran-2-yl]-(4-methoxyphenyl)methanone

C16H14O3 — CID 132502479

IUPAC[(2R)-2,3-dihydro-1-benzofuran-2-yl]-(4-methoxyphenyl)methanone
SMILESCOc1ccc(C(=O)[C@H]2Cc3ccccc3O2)cc1
InChIInChI=1S/C16H14O3/c1-18-13-8-6-11(7-9-13)16(17)15-10-12-4-2-3-5-14(12)19-15/h2-9,15H,10H2,1H3/t15-/m1/s1
InChIKeyQAYLCNHBOQRFSS-OAHLLOKOSA-N
MW254.29 g/mol
LogP2.88
Rot. Bonds3

About [(2R)-2,3-dihydro-1-benzofuran-2-yl]-(4-methoxyphenyl)methanone

[(2R)-2,3-dihydro-1-benzofuran-2-yl]-(4-methoxyphenyl)methanone (PubChem CID 132502479) has the molecular formula C16H14O3 and a molecular weight of 254.29 g/mol. Its IUPAC name is [(2R)-2,3-dihydro-1-benzofuran-2-yl]-(4-methoxyphenyl)methanone.

Molecular Properties

Compound Name[(2R)-2,3-dihydro-1-benzofuran-2-yl]-(4-methoxyphenyl)methanone
PubChem CID132502479
Molecular FormulaC16H14O3
Molecular Weight254.29 g/mol
Exact Mass254.09
IUPAC Name[(2R)-2,3-dihydro-1-benzofuran-2-yl]-(4-methoxyphenyl)methanone
SMILESCOc1ccc(C(=O)[C@H]2Cc3ccccc3O2)cc1
InChIInChI=1S/C16H14O3/c1-18-13-8-6-11(7-9-13)16(17)15-10-12-4-2-3-5-14(12)19-15/h2-9,15H,10H2,1H3/t15-/m1/s1
InChIKeyQAYLCNHBOQRFSS-OAHLLOKOSA-N
XLogP2.88
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,3-dihydro-1-benzofuran-2-yl-(4-propan-2-yloxyphenyl)methanone
CID 43339571
N-[(6-methoxynaphthalen-2-yl)methyl]-2,3-dihydro-1-benzofuran-2-carboxamide
CID 51317174
[(2S)-2,3-dihydro-1-benzofuran-2-yl]-[(2S)-2-(4-methoxyphenyl)pyrrolidin-1-yl]methanone
CID 36671807
(3-chlorophenyl)-[(2R)-2,3-dihydro-1-benzofuran-2-yl]methanone
CID 132502482
N-(4-methoxyphenyl)-N-(thiophen-2-ylmethyl)-2,3-dihydro-1-benzofuran-2-carboxamide
CID 134012847
2,3-dihydro-1-benzofuran-2-yl-(2,4-dimethylphenyl)methanone
CID 43337896
[(2R,3R)-2-(4-methoxyphenyl)-3,4-dihydro-2H-chromen-3-yl] acetate
CID 10756490
(Z)-2-(2,3-dihydro-1-benzofuran-2-yl)but-2-enamide
CID 90190601
(2S)-6-methoxy-2,3-dihydro-1-benzofuran-2-carboxylic acid
CID 10686807
N-[4-(2-methoxyphenoxy)phenyl]-2,3-dihydro-1-benzofuran-2-carboxamide
CID 24529970
N-(2-methoxyphenyl)-2,3-dihydro-1-benzofuran-2-carboxamide
CID 17392144
N-[2-(2,5-dimethoxyphenyl)ethyl]-2,3-dihydro-1-benzofuran-2-carboxamide
CID 110698832

Frequently Asked Questions

What is the IUPAC name of [(2R)-2,3-dihydro-1-benzofuran-2-yl]-(4-methoxyphenyl)methanone?
The IUPAC name of [(2R)-2,3-dihydro-1-benzofuran-2-yl]-(4-methoxyphenyl)methanone (CID 132502479) is [(2R)-2,3-dihydro-1-benzofuran-2-yl]-(4-methoxyphenyl)methanone.
What is the SMILES notation for [(2R)-2,3-dihydro-1-benzofuran-2-yl]-(4-methoxyphenyl)methanone?
The canonical SMILES for [(2R)-2,3-dihydro-1-benzofuran-2-yl]-(4-methoxyphenyl)methanone is COc1ccc(C(=O)[C@H]2Cc3ccccc3O2)cc1.
What is the InChIKey of [(2R)-2,3-dihydro-1-benzofuran-2-yl]-(4-methoxyphenyl)methanone?
The InChIKey is QAYLCNHBOQRFSS-OAHLLOKOSA-N. The full InChI is InChI=1S/C16H14O3/c1-18-13-8-6-11(7-9-13)16(17)15-10-12-4-2-3-5-14(12)19-15/h2-9,15H,10H2,1H3/t15-/m1/s1.
What are the key properties of [(2R)-2,3-dihydro-1-benzofuran-2-yl]-(4-methoxyphenyl)methanone?
[(2R)-2,3-dihydro-1-benzofuran-2-yl]-(4-methoxyphenyl)methanone has a molecular weight of 254.29 g/mol, XLogP of 2.88, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-2,3-dihydro-1-benzofuran-2-yl]-(4-methoxyphenyl)methanone is sourced from PubChem (CID 132502479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).