(3,5-dimethoxypyrazin-2-yl)-(2,6-dimethyl-4-pyridinyl)methanol

C14H17N3O3 — CID 107502705

IUPAC(3,5-dimethoxypyrazin-2-yl)-(2,6-dimethyl-4-pyridinyl)methanol
SMILESCOc1cnc(C(O)c2cc(C)nc(C)c2)c(OC)n1
InChIInChI=1S/C14H17N3O3/c1-8-5-10(6-9(2)16-8)13(18)12-14(20-4)17-11(19-3)7-15-12/h5-7,13,18H,1-4H3
InChIKeyBPQJZIHYVDXGFD-UHFFFAOYSA-N
MW275.31 g/mol
LogP1.59
Rot. Bonds4

About (3,5-dimethoxypyrazin-2-yl)-(2,6-dimethyl-4-pyridinyl)methanol

(3,5-dimethoxypyrazin-2-yl)-(2,6-dimethyl-4-pyridinyl)methanol (PubChem CID 107502705) has the molecular formula C14H17N3O3 and a molecular weight of 275.31 g/mol. Its IUPAC name is (3,5-dimethoxypyrazin-2-yl)-(2,6-dimethyl-4-pyridinyl)methanol.

Molecular Properties

Compound Name(3,5-dimethoxypyrazin-2-yl)-(2,6-dimethyl-4-pyridinyl)methanol
PubChem CID107502705
Molecular FormulaC14H17N3O3
Molecular Weight275.31 g/mol
Exact Mass275.13
IUPAC Name(3,5-dimethoxypyrazin-2-yl)-(2,6-dimethyl-4-pyridinyl)methanol
SMILESCOc1cnc(C(O)c2cc(C)nc(C)c2)c(OC)n1
InChIInChI=1S/C14H17N3O3/c1-8-5-10(6-9(2)16-8)13(18)12-14(20-4)17-11(19-3)7-15-12/h5-7,13,18H,1-4H3
InChIKeyBPQJZIHYVDXGFD-UHFFFAOYSA-N
XLogP1.59
TPSA77.36 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (3,5-dimethoxypyrazin-2-yl)-(2,6-dimethyl-4-pyridinyl)methanol?
The IUPAC name of (3,5-dimethoxypyrazin-2-yl)-(2,6-dimethyl-4-pyridinyl)methanol (CID 107502705) is (3,5-dimethoxypyrazin-2-yl)-(2,6-dimethyl-4-pyridinyl)methanol.
What is the SMILES notation for (3,5-dimethoxypyrazin-2-yl)-(2,6-dimethyl-4-pyridinyl)methanol?
The canonical SMILES for (3,5-dimethoxypyrazin-2-yl)-(2,6-dimethyl-4-pyridinyl)methanol is COc1cnc(C(O)c2cc(C)nc(C)c2)c(OC)n1.
What is the InChIKey of (3,5-dimethoxypyrazin-2-yl)-(2,6-dimethyl-4-pyridinyl)methanol?
The InChIKey is BPQJZIHYVDXGFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O3/c1-8-5-10(6-9(2)16-8)13(18)12-14(20-4)17-11(19-3)7-15-12/h5-7,13,18H,1-4H3.
What are the key properties of (3,5-dimethoxypyrazin-2-yl)-(2,6-dimethyl-4-pyridinyl)methanol?
(3,5-dimethoxypyrazin-2-yl)-(2,6-dimethyl-4-pyridinyl)methanol has a molecular weight of 275.31 g/mol, XLogP of 1.59, 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)-(2,6-dimethyl-4-pyridinyl)methanol is sourced from PubChem (CID 107502705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).