(7-fluoro-1-benzofuran-2-yl)-(5-methylpyrazin-2-yl)methanol

C14H11FN2O2 — CID 105130111

IUPAC(7-fluoro-1-benzofuran-2-yl)-(5-methylpyrazin-2-yl)methanol
SMILESCc1cnc(C(O)c2cc3cccc(F)c3o2)cn1
InChIInChI=1S/C14H11FN2O2/c1-8-6-17-11(7-16-8)13(18)12-5-9-3-2-4-10(15)14(9)19-12/h2-7,13,18H,1H3
InChIKeyNJYPTHHIDZOJDW-UHFFFAOYSA-N
MW258.25 g/mol
LogP2.75
Rot. Bonds2

About (7-fluoro-1-benzofuran-2-yl)-(5-methylpyrazin-2-yl)methanol

(7-fluoro-1-benzofuran-2-yl)-(5-methylpyrazin-2-yl)methanol (PubChem CID 105130111) has the molecular formula C14H11FN2O2 and a molecular weight of 258.25 g/mol. Its IUPAC name is (7-fluoro-1-benzofuran-2-yl)-(5-methylpyrazin-2-yl)methanol.

Molecular Properties

Compound Name(7-fluoro-1-benzofuran-2-yl)-(5-methylpyrazin-2-yl)methanol
PubChem CID105130111
Molecular FormulaC14H11FN2O2
Molecular Weight258.25 g/mol
Exact Mass258.08
IUPAC Name(7-fluoro-1-benzofuran-2-yl)-(5-methylpyrazin-2-yl)methanol
SMILESCc1cnc(C(O)c2cc3cccc(F)c3o2)cn1
InChIInChI=1S/C14H11FN2O2/c1-8-6-17-11(7-16-8)13(18)12-5-9-3-2-4-10(15)14(9)19-12/h2-7,13,18H,1H3
InChIKeyNJYPTHHIDZOJDW-UHFFFAOYSA-N
XLogP2.75
TPSA59.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.25
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(7-fluoro-1-benzofuran-2-yl)-(3-fluoro-4-methylphenyl)methanol
CID 114723604
1-benzofuran-2-yl-(7-fluoro-1-benzofuran-2-yl)methanol
CID 114723565
(7-fluoro-1-benzofuran-2-yl)-(2,4,6-trifluorophenyl)methanol
CID 115836932
(5-chloro-2-methylphenyl)-(7-fluoro-1-benzofuran-2-yl)methanol
CID 115837002
(7-fluoro-1-benzofuran-2-yl)-(furan-2-yl)methanol
CID 114723330
7-fluoro-2-propan-2-yl-1-benzofuran
CID 88991552
(7-fluoro-1-benzofuran-2-yl)-(4-iodophenyl)methanol
CID 115836962
(7-fluoro-1-benzofuran-2-yl)-thieno[3,2-b]pyridin-6-ylmethanol
CID 114727100
(7-fluoro-1-benzofuran-2-yl)-(2-methylpyrimidin-4-yl)methanamine
CID 114730572
1,3-dihydro-2-benzofuran-5-yl-(7-fluoro-1-benzofuran-2-yl)methanol
CID 115836912
(7-fluoro-1-benzofuran-2-yl)-(3-methoxy-4-methylphenyl)methanol
CID 115836972
(2,4-difluorophenyl)-(5-methylpyrazin-2-yl)methanol
CID 105094711

Frequently Asked Questions

What is the IUPAC name of (7-fluoro-1-benzofuran-2-yl)-(5-methylpyrazin-2-yl)methanol?
The IUPAC name of (7-fluoro-1-benzofuran-2-yl)-(5-methylpyrazin-2-yl)methanol (CID 105130111) is (7-fluoro-1-benzofuran-2-yl)-(5-methylpyrazin-2-yl)methanol.
What is the SMILES notation for (7-fluoro-1-benzofuran-2-yl)-(5-methylpyrazin-2-yl)methanol?
The canonical SMILES for (7-fluoro-1-benzofuran-2-yl)-(5-methylpyrazin-2-yl)methanol is Cc1cnc(C(O)c2cc3cccc(F)c3o2)cn1.
What is the InChIKey of (7-fluoro-1-benzofuran-2-yl)-(5-methylpyrazin-2-yl)methanol?
The InChIKey is NJYPTHHIDZOJDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11FN2O2/c1-8-6-17-11(7-16-8)13(18)12-5-9-3-2-4-10(15)14(9)19-12/h2-7,13,18H,1H3.
What are the key properties of (7-fluoro-1-benzofuran-2-yl)-(5-methylpyrazin-2-yl)methanol?
(7-fluoro-1-benzofuran-2-yl)-(5-methylpyrazin-2-yl)methanol has a molecular weight of 258.25 g/mol, XLogP of 2.75, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (7-fluoro-1-benzofuran-2-yl)-(5-methylpyrazin-2-yl)methanol is sourced from PubChem (CID 105130111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).