(3,5-dimethoxypyrazin-2-yl)-(5-fluoro-3-pyridinyl)methanol

C12H12FN3O3 — CID 105123520

IUPAC(3,5-dimethoxypyrazin-2-yl)-(5-fluoro-3-pyridinyl)methanol
SMILESCOc1cnc(C(O)c2cncc(F)c2)c(OC)n1
InChIInChI=1S/C12H12FN3O3/c1-18-9-6-15-10(12(16-9)19-2)11(17)7-3-8(13)5-14-4-7/h3-6,11,17H,1-2H3
InChIKeyVMIMAQYFJUAQPT-UHFFFAOYSA-N
MW265.24 g/mol
LogP1.11
Rot. Bonds4

About (3,5-dimethoxypyrazin-2-yl)-(5-fluoro-3-pyridinyl)methanol

(3,5-dimethoxypyrazin-2-yl)-(5-fluoro-3-pyridinyl)methanol (PubChem CID 105123520) has the molecular formula C12H12FN3O3 and a molecular weight of 265.24 g/mol. Its IUPAC name is (3,5-dimethoxypyrazin-2-yl)-(5-fluoro-3-pyridinyl)methanol.

Molecular Properties

Compound Name(3,5-dimethoxypyrazin-2-yl)-(5-fluoro-3-pyridinyl)methanol
PubChem CID105123520
Molecular FormulaC12H12FN3O3
Molecular Weight265.24 g/mol
Exact Mass265.09
IUPAC Name(3,5-dimethoxypyrazin-2-yl)-(5-fluoro-3-pyridinyl)methanol
SMILESCOc1cnc(C(O)c2cncc(F)c2)c(OC)n1
InChIInChI=1S/C12H12FN3O3/c1-18-9-6-15-10(12(16-9)19-2)11(17)7-3-8(13)5-14-4-7/h3-6,11,17H,1-2H3
InChIKeyVMIMAQYFJUAQPT-UHFFFAOYSA-N
XLogP1.11
TPSA77.36 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.24
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

(5-fluoro-3-pyridinyl)-(5-methoxy-3-pyridinyl)methanol
CID 105121302
(3,5-dimethoxypyrazin-2-yl)-(2,6-dimethyl-4-pyridinyl)methanol
CID 107502705
(5-chloro-2-fluorophenyl)-(3,5-dimethoxypyrazin-2-yl)methanol
CID 114853257
(3,5-dimethoxypyrazin-2-yl)-(2,4,6-trifluorophenyl)methanamine
CID 105031257
(3,5-dimethoxypyrazin-2-yl)-(1,3-thiazol-4-yl)methanol
CID 113404120
1-(3,5-dimethoxypyrazin-2-yl)-2,2-difluoroethanamine
CID 103517039
(3,5-dimethoxypyrazin-2-yl)-(1-methylimidazol-4-yl)methanol
CID 107978634
2-cyclopropyl-1-(3,5-dimethoxypyrazin-2-yl)propan-1-ol
CID 115830716
(3-ethyl-2-pyridinyl)-(5-fluoro-3-pyridinyl)methanol
CID 82730372
1-(3,5-dimethoxypyrazin-2-yl)-2-methoxy-3-methylbutan-1-ol
CID 116711920
1-(3,5-dimethoxypyrazin-2-yl)-2-methoxy-N-methylethanamine
CID 105178224
1-(3,5-dimethoxypyrazin-2-yl)-2,3,3-trimethylbutan-1-ol
CID 114270663

Frequently Asked Questions

What is the IUPAC name of (3,5-dimethoxypyrazin-2-yl)-(5-fluoro-3-pyridinyl)methanol?
The IUPAC name of (3,5-dimethoxypyrazin-2-yl)-(5-fluoro-3-pyridinyl)methanol (CID 105123520) is (3,5-dimethoxypyrazin-2-yl)-(5-fluoro-3-pyridinyl)methanol.
What is the SMILES notation for (3,5-dimethoxypyrazin-2-yl)-(5-fluoro-3-pyridinyl)methanol?
The canonical SMILES for (3,5-dimethoxypyrazin-2-yl)-(5-fluoro-3-pyridinyl)methanol is COc1cnc(C(O)c2cncc(F)c2)c(OC)n1.
What is the InChIKey of (3,5-dimethoxypyrazin-2-yl)-(5-fluoro-3-pyridinyl)methanol?
The InChIKey is VMIMAQYFJUAQPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12FN3O3/c1-18-9-6-15-10(12(16-9)19-2)11(17)7-3-8(13)5-14-4-7/h3-6,11,17H,1-2H3.
What are the key properties of (3,5-dimethoxypyrazin-2-yl)-(5-fluoro-3-pyridinyl)methanol?
(3,5-dimethoxypyrazin-2-yl)-(5-fluoro-3-pyridinyl)methanol has a molecular weight of 265.24 g/mol, XLogP of 1.11, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dimethoxypyrazin-2-yl)-(5-fluoro-3-pyridinyl)methanol is sourced from PubChem (CID 105123520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).