(7-methyl-1-benzofuran-2-yl)-(2-methyl-3-pyridinyl)methanol

C16H15NO2 — CID 105129303

IUPAC(7-methyl-1-benzofuran-2-yl)-(2-methyl-3-pyridinyl)methanol
SMILESCc1ncccc1C(O)c1cc2cccc(C)c2o1
InChIInChI=1S/C16H15NO2/c1-10-5-3-6-12-9-14(19-16(10)12)15(18)13-7-4-8-17-11(13)2/h3-9,15,18H,1-2H3
InChIKeyIMYCHTFYUTYPFZ-UHFFFAOYSA-N
MW253.30 g/mol
LogP3.53
Rot. Bonds2

About (7-methyl-1-benzofuran-2-yl)-(2-methyl-3-pyridinyl)methanol

(7-methyl-1-benzofuran-2-yl)-(2-methyl-3-pyridinyl)methanol (PubChem CID 105129303) has the molecular formula C16H15NO2 and a molecular weight of 253.30 g/mol. Its IUPAC name is (7-methyl-1-benzofuran-2-yl)-(2-methyl-3-pyridinyl)methanol.

Molecular Properties

Compound Name(7-methyl-1-benzofuran-2-yl)-(2-methyl-3-pyridinyl)methanol
PubChem CID105129303
Molecular FormulaC16H15NO2
Molecular Weight253.30 g/mol
Exact Mass253.11
IUPAC Name(7-methyl-1-benzofuran-2-yl)-(2-methyl-3-pyridinyl)methanol
SMILESCc1ncccc1C(O)c1cc2cccc(C)c2o1
InChIInChI=1S/C16H15NO2/c1-10-5-3-6-12-9-14(19-16(10)12)15(18)13-7-4-8-17-11(13)2/h3-9,15,18H,1-2H3
InChIKeyIMYCHTFYUTYPFZ-UHFFFAOYSA-N
XLogP3.53
TPSA46.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.30
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3-ethyl-2-pyridinyl)-(7-methyl-1-benzofuran-2-yl)methanol
CID 114727223
(2,3-dichlorophenyl)-(7-methyl-1-benzofuran-2-yl)methanol
CID 114723415
(2-ethoxyphenyl)-(7-methyl-1-benzofuran-2-yl)methanol
CID 114723269
(3-fluoro-4-pyridinyl)-(7-methyl-1-benzofuran-2-yl)methanol
CID 114727130
(2-methylphenyl)-(2-methyl-3-pyridinyl)methanol
CID 105078767
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
(7-methyl-1-benzofuran-2-yl)-(2,4,5-trimethylfuran-3-yl)methanol
CID 115836437
(3,4-dichlorophenyl)-(7-methyl-1-benzofuran-2-yl)methanol
CID 114723344
(2-amino-5-fluorophenyl)-(7-methyl-1-benzofuran-2-yl)methanol
CID 114727209
(2,6-dimethyl-3-pyridinyl)-(7-methyl-1-benzofuran-2-yl)methanamine
CID 105185520
(3-bromofuran-2-yl)-(7-methyl-1-benzofuran-2-yl)methanol
CID 106886296

Frequently Asked Questions

What is the IUPAC name of (7-methyl-1-benzofuran-2-yl)-(2-methyl-3-pyridinyl)methanol?
The IUPAC name of (7-methyl-1-benzofuran-2-yl)-(2-methyl-3-pyridinyl)methanol (CID 105129303) is (7-methyl-1-benzofuran-2-yl)-(2-methyl-3-pyridinyl)methanol.
What is the SMILES notation for (7-methyl-1-benzofuran-2-yl)-(2-methyl-3-pyridinyl)methanol?
The canonical SMILES for (7-methyl-1-benzofuran-2-yl)-(2-methyl-3-pyridinyl)methanol is Cc1ncccc1C(O)c1cc2cccc(C)c2o1.
What is the InChIKey of (7-methyl-1-benzofuran-2-yl)-(2-methyl-3-pyridinyl)methanol?
The InChIKey is IMYCHTFYUTYPFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO2/c1-10-5-3-6-12-9-14(19-16(10)12)15(18)13-7-4-8-17-11(13)2/h3-9,15,18H,1-2H3.
What are the key properties of (7-methyl-1-benzofuran-2-yl)-(2-methyl-3-pyridinyl)methanol?
(7-methyl-1-benzofuran-2-yl)-(2-methyl-3-pyridinyl)methanol has a molecular weight of 253.30 g/mol, XLogP of 3.53, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (7-methyl-1-benzofuran-2-yl)-(2-methyl-3-pyridinyl)methanol is sourced from PubChem (CID 105129303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).