2-[(3-amino-6-methyl-2-pyridinyl)oxy]ethanol

C8H12N2O2 — CID 81133074

IUPAC2-[(3-amino-6-methyl-2-pyridinyl)oxy]ethanol
SMILESCc1ccc(N)c(OCCO)n1
InChIInChI=1S/C8H12N2O2/c1-6-2-3-7(9)8(10-6)12-5-4-11/h2-3,11H,4-5,9H2,1H3
InChIKeyJJQWCRDNSRNCFP-UHFFFAOYSA-N
MW168.20 g/mol
LogP0.34
Rot. Bonds3

About 2-[(3-amino-6-methyl-2-pyridinyl)oxy]ethanol

2-[(3-amino-6-methyl-2-pyridinyl)oxy]ethanol (PubChem CID 81133074) has the molecular formula C8H12N2O2 and a molecular weight of 168.20 g/mol. Its IUPAC name is 2-[(3-amino-6-methyl-2-pyridinyl)oxy]ethanol.

Molecular Properties

Compound Name2-[(3-amino-6-methyl-2-pyridinyl)oxy]ethanol
PubChem CID81133074
Molecular FormulaC8H12N2O2
Molecular Weight168.20 g/mol
Exact Mass168.09
IUPAC Name2-[(3-amino-6-methyl-2-pyridinyl)oxy]ethanol
SMILESCc1ccc(N)c(OCCO)n1
InChIInChI=1S/C8H12N2O2/c1-6-2-3-7(9)8(10-6)12-5-4-11/h2-3,11H,4-5,9H2,1H3
InChIKeyJJQWCRDNSRNCFP-UHFFFAOYSA-N
XLogP0.34
TPSA68.37 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.20
LogP ≤ 50.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(3-amino-6-methyl-2-pyridinyl)oxy]ethanol?
The IUPAC name of 2-[(3-amino-6-methyl-2-pyridinyl)oxy]ethanol (CID 81133074) is 2-[(3-amino-6-methyl-2-pyridinyl)oxy]ethanol.
What is the SMILES notation for 2-[(3-amino-6-methyl-2-pyridinyl)oxy]ethanol?
The canonical SMILES for 2-[(3-amino-6-methyl-2-pyridinyl)oxy]ethanol is Cc1ccc(N)c(OCCO)n1.
What is the InChIKey of 2-[(3-amino-6-methyl-2-pyridinyl)oxy]ethanol?
The InChIKey is JJQWCRDNSRNCFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O2/c1-6-2-3-7(9)8(10-6)12-5-4-11/h2-3,11H,4-5,9H2,1H3.
What are the key properties of 2-[(3-amino-6-methyl-2-pyridinyl)oxy]ethanol?
2-[(3-amino-6-methyl-2-pyridinyl)oxy]ethanol has a molecular weight of 168.20 g/mol, XLogP of 0.34, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-amino-6-methyl-2-pyridinyl)oxy]ethanol is sourced from PubChem (CID 81133074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).