2-(2-amino-4-pyridinyl)-1-(6-methoxy-2-pyridinyl)ethanol

C13H15N3O2 — CID 103347981

IUPAC2-(2-amino-4-pyridinyl)-1-(6-methoxy-2-pyridinyl)ethanol
SMILESCOc1cccc(C(O)Cc2ccnc(N)c2)n1
InChIInChI=1S/C13H15N3O2/c1-18-13-4-2-3-10(16-13)11(17)7-9-5-6-15-12(14)8-9/h2-6,8,11,17H,7H2,1H3,(H2,14,15)
InChIKeyXMQGCNPZMOGIPN-UHFFFAOYSA-N
MW245.28 g/mol
LogP1.34
Rot. Bonds4

About 2-(2-amino-4-pyridinyl)-1-(6-methoxy-2-pyridinyl)ethanol

2-(2-amino-4-pyridinyl)-1-(6-methoxy-2-pyridinyl)ethanol (PubChem CID 103347981) has the molecular formula C13H15N3O2 and a molecular weight of 245.28 g/mol. Its IUPAC name is 2-(2-amino-4-pyridinyl)-1-(6-methoxy-2-pyridinyl)ethanol.

Molecular Properties

Compound Name2-(2-amino-4-pyridinyl)-1-(6-methoxy-2-pyridinyl)ethanol
PubChem CID103347981
Molecular FormulaC13H15N3O2
Molecular Weight245.28 g/mol
Exact Mass245.12
IUPAC Name2-(2-amino-4-pyridinyl)-1-(6-methoxy-2-pyridinyl)ethanol
SMILESCOc1cccc(C(O)Cc2ccnc(N)c2)n1
InChIInChI=1S/C13H15N3O2/c1-18-13-4-2-3-10(16-13)11(17)7-9-5-6-15-12(14)8-9/h2-6,8,11,17H,7H2,1H3,(H2,14,15)
InChIKeyXMQGCNPZMOGIPN-UHFFFAOYSA-N
XLogP1.34
TPSA81.26 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-4-pyridinyl)-1-(6-methoxy-2-pyridinyl)ethanol?
The IUPAC name of 2-(2-amino-4-pyridinyl)-1-(6-methoxy-2-pyridinyl)ethanol (CID 103347981) is 2-(2-amino-4-pyridinyl)-1-(6-methoxy-2-pyridinyl)ethanol.
What is the SMILES notation for 2-(2-amino-4-pyridinyl)-1-(6-methoxy-2-pyridinyl)ethanol?
The canonical SMILES for 2-(2-amino-4-pyridinyl)-1-(6-methoxy-2-pyridinyl)ethanol is COc1cccc(C(O)Cc2ccnc(N)c2)n1.
What is the InChIKey of 2-(2-amino-4-pyridinyl)-1-(6-methoxy-2-pyridinyl)ethanol?
The InChIKey is XMQGCNPZMOGIPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2/c1-18-13-4-2-3-10(16-13)11(17)7-9-5-6-15-12(14)8-9/h2-6,8,11,17H,7H2,1H3,(H2,14,15).
What are the key properties of 2-(2-amino-4-pyridinyl)-1-(6-methoxy-2-pyridinyl)ethanol?
2-(2-amino-4-pyridinyl)-1-(6-methoxy-2-pyridinyl)ethanol has a molecular weight of 245.28 g/mol, XLogP of 1.34, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-4-pyridinyl)-1-(6-methoxy-2-pyridinyl)ethanol is sourced from PubChem (CID 103347981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).