[2-[(5-amino-4-methyl-2-pyridinyl)oxy]phenyl]methanol

C13H14N2O2 — CID 79175989

IUPAC[2-[(5-amino-4-methyl-2-pyridinyl)oxy]phenyl]methanol
SMILESCc1cc(Oc2ccccc2CO)ncc1N
InChIInChI=1S/C13H14N2O2/c1-9-6-13(15-7-11(9)14)17-12-5-3-2-4-10(12)8-16/h2-7,16H,8,14H2,1H3
InChIKeyLGDSXHSDUIANCT-UHFFFAOYSA-N
MW230.27 g/mol
LogP2.26
Rot. Bonds3

About [2-[(5-amino-4-methyl-2-pyridinyl)oxy]phenyl]methanol

[2-[(5-amino-4-methyl-2-pyridinyl)oxy]phenyl]methanol (PubChem CID 79175989) has the molecular formula C13H14N2O2 and a molecular weight of 230.27 g/mol. Its IUPAC name is [2-[(5-amino-4-methyl-2-pyridinyl)oxy]phenyl]methanol.

Molecular Properties

Compound Name[2-[(5-amino-4-methyl-2-pyridinyl)oxy]phenyl]methanol
PubChem CID79175989
Molecular FormulaC13H14N2O2
Molecular Weight230.27 g/mol
Exact Mass230.11
IUPAC Name[2-[(5-amino-4-methyl-2-pyridinyl)oxy]phenyl]methanol
SMILESCc1cc(Oc2ccccc2CO)ncc1N
InChIInChI=1S/C13H14N2O2/c1-9-6-13(15-7-11(9)14)17-12-5-3-2-4-10(12)8-16/h2-7,16H,8,14H2,1H3
InChIKeyLGDSXHSDUIANCT-UHFFFAOYSA-N
XLogP2.26
TPSA68.37 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [2-[(5-amino-4-methyl-2-pyridinyl)oxy]phenyl]methanol?
The IUPAC name of [2-[(5-amino-4-methyl-2-pyridinyl)oxy]phenyl]methanol (CID 79175989) is [2-[(5-amino-4-methyl-2-pyridinyl)oxy]phenyl]methanol.
What is the SMILES notation for [2-[(5-amino-4-methyl-2-pyridinyl)oxy]phenyl]methanol?
The canonical SMILES for [2-[(5-amino-4-methyl-2-pyridinyl)oxy]phenyl]methanol is Cc1cc(Oc2ccccc2CO)ncc1N.
What is the InChIKey of [2-[(5-amino-4-methyl-2-pyridinyl)oxy]phenyl]methanol?
The InChIKey is LGDSXHSDUIANCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2/c1-9-6-13(15-7-11(9)14)17-12-5-3-2-4-10(12)8-16/h2-7,16H,8,14H2,1H3.
What are the key properties of [2-[(5-amino-4-methyl-2-pyridinyl)oxy]phenyl]methanol?
[2-[(5-amino-4-methyl-2-pyridinyl)oxy]phenyl]methanol has a molecular weight of 230.27 g/mol, XLogP of 2.26, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(5-amino-4-methyl-2-pyridinyl)oxy]phenyl]methanol is sourced from PubChem (CID 79175989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).