2,3-dihydro-1H-inden-2-yl-(7-methyl-1-benzofuran-2-yl)methanol

C19H18O2 — CID 114726715

IUPAC2,3-dihydro-1H-inden-2-yl-(7-methyl-1-benzofuran-2-yl)methanol
SMILESCc1cccc2cc(C(O)C3Cc4ccccc4C3)oc12
InChIInChI=1S/C19H18O2/c1-12-5-4-8-15-11-17(21-19(12)15)18(20)16-9-13-6-2-3-7-14(13)10-16/h2-8,11,16,18,20H,9-10H2,1H3
InChIKeySPUTULBBGNAADU-UHFFFAOYSA-N
MW278.35 g/mol
LogP4.19
Rot. Bonds2

About 2,3-dihydro-1H-inden-2-yl-(7-methyl-1-benzofuran-2-yl)methanol

2,3-dihydro-1H-inden-2-yl-(7-methyl-1-benzofuran-2-yl)methanol (PubChem CID 114726715) has the molecular formula C19H18O2 and a molecular weight of 278.35 g/mol. Its IUPAC name is 2,3-dihydro-1H-inden-2-yl-(7-methyl-1-benzofuran-2-yl)methanol.

Molecular Properties

Compound Name2,3-dihydro-1H-inden-2-yl-(7-methyl-1-benzofuran-2-yl)methanol
PubChem CID114726715
Molecular FormulaC19H18O2
Molecular Weight278.35 g/mol
Exact Mass278.13
IUPAC Name2,3-dihydro-1H-inden-2-yl-(7-methyl-1-benzofuran-2-yl)methanol
SMILESCc1cccc2cc(C(O)C3Cc4ccccc4C3)oc12
InChIInChI=1S/C19H18O2/c1-12-5-4-8-15-11-17(21-19(12)15)18(20)16-9-13-6-2-3-7-14(13)10-16/h2-8,11,16,18,20H,9-10H2,1H3
InChIKeySPUTULBBGNAADU-UHFFFAOYSA-N
XLogP4.19
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(7-methyl-1-benzofuran-2-yl)-piperidin-3-ylmethanol
CID 114724344
cyclohex-3-en-1-yl-(7-methyl-1-benzofuran-2-yl)methanol
CID 114723714
1-benzofuran-2-yl-(7-methyl-1-benzofuran-2-yl)methanol
CID 114723563
(7-methyl-1-benzofuran-2-yl)-(7-oxabicyclo[2.2.1]heptan-2-yl)methanol
CID 114726549
[7-bicyclo[4.2.0]octa-1,3,5-trienyl-(7-methyl-1-benzofuran-2-yl)methyl]hydrazine
CID 105224637
(3,5-dimethylphenyl)-(7-methyl-1-benzofuran-2-yl)methanol
CID 114723638
(7-methyl-1-benzofuran-2-yl)-(1-methylcyclopentyl)methanol
CID 115836488
(7-methyl-1-benzofuran-2-yl)-(2,4,5-trimethylfuran-3-yl)methanol
CID 115836437
3,3,3-trifluoro-1-(7-methyl-1-benzofuran-2-yl)-2-(trifluoromethyl)propan-1-ol
CID 103312648
(3-cyclopropylphenyl)-(7-methyl-1-benzofuran-2-yl)methanol
CID 114724253
(7-chloro-1-benzofuran-2-yl)-(4-propan-2-ylcyclohexyl)methanol
CID 114726690
2,3-dihydro-1H-inden-2-yl-(2,4-dimethylphenyl)methanol
CID 65410977

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-inden-2-yl-(7-methyl-1-benzofuran-2-yl)methanol?
The IUPAC name of 2,3-dihydro-1H-inden-2-yl-(7-methyl-1-benzofuran-2-yl)methanol (CID 114726715) is 2,3-dihydro-1H-inden-2-yl-(7-methyl-1-benzofuran-2-yl)methanol.
What is the SMILES notation for 2,3-dihydro-1H-inden-2-yl-(7-methyl-1-benzofuran-2-yl)methanol?
The canonical SMILES for 2,3-dihydro-1H-inden-2-yl-(7-methyl-1-benzofuran-2-yl)methanol is Cc1cccc2cc(C(O)C3Cc4ccccc4C3)oc12.
What is the InChIKey of 2,3-dihydro-1H-inden-2-yl-(7-methyl-1-benzofuran-2-yl)methanol?
The InChIKey is SPUTULBBGNAADU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18O2/c1-12-5-4-8-15-11-17(21-19(12)15)18(20)16-9-13-6-2-3-7-14(13)10-16/h2-8,11,16,18,20H,9-10H2,1H3.
What are the key properties of 2,3-dihydro-1H-inden-2-yl-(7-methyl-1-benzofuran-2-yl)methanol?
2,3-dihydro-1H-inden-2-yl-(7-methyl-1-benzofuran-2-yl)methanol has a molecular weight of 278.35 g/mol, XLogP of 4.19, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-inden-2-yl-(7-methyl-1-benzofuran-2-yl)methanol is sourced from PubChem (CID 114726715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).