[5-methyl-6-[(2-methyl-3-pyridinyl)oxy]-3-pyridinyl]methanol

C13H14N2O2 — CID 80628218

IUPAC[5-methyl-6-[(2-methyl-3-pyridinyl)oxy]-3-pyridinyl]methanol
SMILESCc1cc(CO)cnc1Oc1cccnc1C
InChIInChI=1S/C13H14N2O2/c1-9-6-11(8-16)7-15-13(9)17-12-4-3-5-14-10(12)2/h3-7,16H,8H2,1-2H3
InChIKeyKVGCJGUWZZGENC-UHFFFAOYSA-N
MW230.27 g/mol
LogP2.38
Rot. Bonds3

About [5-methyl-6-[(2-methyl-3-pyridinyl)oxy]-3-pyridinyl]methanol

[5-methyl-6-[(2-methyl-3-pyridinyl)oxy]-3-pyridinyl]methanol (PubChem CID 80628218) has the molecular formula C13H14N2O2 and a molecular weight of 230.27 g/mol. Its IUPAC name is [5-methyl-6-[(2-methyl-3-pyridinyl)oxy]-3-pyridinyl]methanol.

Molecular Properties

Compound Name[5-methyl-6-[(2-methyl-3-pyridinyl)oxy]-3-pyridinyl]methanol
PubChem CID80628218
Molecular FormulaC13H14N2O2
Molecular Weight230.27 g/mol
Exact Mass230.11
IUPAC Name[5-methyl-6-[(2-methyl-3-pyridinyl)oxy]-3-pyridinyl]methanol
SMILESCc1cc(CO)cnc1Oc1cccnc1C
InChIInChI=1S/C13H14N2O2/c1-9-6-11(8-16)7-15-13(9)17-12-4-3-5-14-10(12)2/h3-7,16H,8H2,1-2H3
InChIKeyKVGCJGUWZZGENC-UHFFFAOYSA-N
XLogP2.38
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [5-methyl-6-[(2-methyl-3-pyridinyl)oxy]-3-pyridinyl]methanol?
The IUPAC name of [5-methyl-6-[(2-methyl-3-pyridinyl)oxy]-3-pyridinyl]methanol (CID 80628218) is [5-methyl-6-[(2-methyl-3-pyridinyl)oxy]-3-pyridinyl]methanol.
What is the SMILES notation for [5-methyl-6-[(2-methyl-3-pyridinyl)oxy]-3-pyridinyl]methanol?
The canonical SMILES for [5-methyl-6-[(2-methyl-3-pyridinyl)oxy]-3-pyridinyl]methanol is Cc1cc(CO)cnc1Oc1cccnc1C.
What is the InChIKey of [5-methyl-6-[(2-methyl-3-pyridinyl)oxy]-3-pyridinyl]methanol?
The InChIKey is KVGCJGUWZZGENC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2/c1-9-6-11(8-16)7-15-13(9)17-12-4-3-5-14-10(12)2/h3-7,16H,8H2,1-2H3.
What are the key properties of [5-methyl-6-[(2-methyl-3-pyridinyl)oxy]-3-pyridinyl]methanol?
[5-methyl-6-[(2-methyl-3-pyridinyl)oxy]-3-pyridinyl]methanol has a molecular weight of 230.27 g/mol, XLogP of 2.38, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-methyl-6-[(2-methyl-3-pyridinyl)oxy]-3-pyridinyl]methanol is sourced from PubChem (CID 80628218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).