(7-methyl-1-benzofuran-2-yl)-(1-methylcyclopentyl)methanol

C16H20O2 — CID 115836488

IUPAC(7-methyl-1-benzofuran-2-yl)-(1-methylcyclopentyl)methanol
SMILESCc1cccc2cc(C(O)C3(C)CCCC3)oc12
InChIInChI=1S/C16H20O2/c1-11-6-5-7-12-10-13(18-14(11)12)15(17)16(2)8-3-4-9-16/h5-7,10,15,17H,3-4,8-9H2,1-2H3
InChIKeyMBSUXIPZIZFJRE-UHFFFAOYSA-N
MW244.33 g/mol
LogP4.35
Rot. Bonds2

About (7-methyl-1-benzofuran-2-yl)-(1-methylcyclopentyl)methanol

(7-methyl-1-benzofuran-2-yl)-(1-methylcyclopentyl)methanol (PubChem CID 115836488) has the molecular formula C16H20O2 and a molecular weight of 244.33 g/mol. Its IUPAC name is (7-methyl-1-benzofuran-2-yl)-(1-methylcyclopentyl)methanol.

Molecular Properties

Compound Name(7-methyl-1-benzofuran-2-yl)-(1-methylcyclopentyl)methanol
PubChem CID115836488
Molecular FormulaC16H20O2
Molecular Weight244.33 g/mol
Exact Mass244.15
IUPAC Name(7-methyl-1-benzofuran-2-yl)-(1-methylcyclopentyl)methanol
SMILESCc1cccc2cc(C(O)C3(C)CCCC3)oc12
InChIInChI=1S/C16H20O2/c1-11-6-5-7-12-10-13(18-14(11)12)15(17)16(2)8-3-4-9-16/h5-7,10,15,17H,3-4,8-9H2,1-2H3
InChIKeyMBSUXIPZIZFJRE-UHFFFAOYSA-N
XLogP4.35
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.33
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2,2-dimethylcyclopentyl)-(7-methyl-1-benzofuran-2-yl)methanamine
CID 107191137
(7-chloro-1-benzofuran-2-yl)-(2-methyloxan-2-yl)methanol
CID 114727098
1-benzofuran-2-yl-(7-methyl-1-benzofuran-2-yl)methanol
CID 114723563
(3,5-dimethylphenyl)-(7-methyl-1-benzofuran-2-yl)methanol
CID 114723638
[1-(dimethylamino)cyclopentyl]-(7-fluoro-1-benzofuran-2-yl)methanol
CID 114726886
(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
8-(7-methyl-1-benzofuran-2-yl)spiro[4.5]decan-8-ol
CID 114819752
2,3-dihydro-1H-inden-2-yl-(7-methyl-1-benzofuran-2-yl)methanol
CID 114726715
(7-methyl-1-benzofuran-2-yl)-(2-methyl-3-pyridinyl)methanol
CID 105129303
1-(2,2-dimethylcyclopropyl)-N-methyl-1-(7-methyl-1-benzofuran-2-yl)methanamine
CID 107005057
(1-aminocyclohexyl)-(7-methyl-1-benzofuran-2-yl)methanone
CID 114736196

Frequently Asked Questions

What is the IUPAC name of (7-methyl-1-benzofuran-2-yl)-(1-methylcyclopentyl)methanol?
The IUPAC name of (7-methyl-1-benzofuran-2-yl)-(1-methylcyclopentyl)methanol (CID 115836488) is (7-methyl-1-benzofuran-2-yl)-(1-methylcyclopentyl)methanol.
What is the SMILES notation for (7-methyl-1-benzofuran-2-yl)-(1-methylcyclopentyl)methanol?
The canonical SMILES for (7-methyl-1-benzofuran-2-yl)-(1-methylcyclopentyl)methanol is Cc1cccc2cc(C(O)C3(C)CCCC3)oc12.
What is the InChIKey of (7-methyl-1-benzofuran-2-yl)-(1-methylcyclopentyl)methanol?
The InChIKey is MBSUXIPZIZFJRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20O2/c1-11-6-5-7-12-10-13(18-14(11)12)15(17)16(2)8-3-4-9-16/h5-7,10,15,17H,3-4,8-9H2,1-2H3.
What are the key properties of (7-methyl-1-benzofuran-2-yl)-(1-methylcyclopentyl)methanol?
(7-methyl-1-benzofuran-2-yl)-(1-methylcyclopentyl)methanol has a molecular weight of 244.33 g/mol, XLogP of 4.35, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (7-methyl-1-benzofuran-2-yl)-(1-methylcyclopentyl)methanol is sourced from PubChem (CID 115836488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).