2-amino-1-(4-methoxy-2-methyl-3-pyridinyl)ethanol

C9H14N2O2 — CID 84658495

IUPAC2-amino-1-(4-methoxy-2-methyl-3-pyridinyl)ethanol
SMILESCOc1ccnc(C)c1C(O)CN
InChIInChI=1S/C9H14N2O2/c1-6-9(7(12)5-10)8(13-2)3-4-11-6/h3-4,7,12H,5,10H2,1-2H3
InChIKeyFULNTMJXPOGFMJ-UHFFFAOYSA-N
MW182.22 g/mol
LogP0.39
Rot. Bonds3

About 2-amino-1-(4-methoxy-2-methyl-3-pyridinyl)ethanol

2-amino-1-(4-methoxy-2-methyl-3-pyridinyl)ethanol (PubChem CID 84658495) has the molecular formula C9H14N2O2 and a molecular weight of 182.22 g/mol. Its IUPAC name is 2-amino-1-(4-methoxy-2-methyl-3-pyridinyl)ethanol.

Molecular Properties

Compound Name2-amino-1-(4-methoxy-2-methyl-3-pyridinyl)ethanol
PubChem CID84658495
Molecular FormulaC9H14N2O2
Molecular Weight182.22 g/mol
Exact Mass182.11
IUPAC Name2-amino-1-(4-methoxy-2-methyl-3-pyridinyl)ethanol
SMILESCOc1ccnc(C)c1C(O)CN
InChIInChI=1S/C9H14N2O2/c1-6-9(7(12)5-10)8(13-2)3-4-11-6/h3-4,7,12H,5,10H2,1-2H3
InChIKeyFULNTMJXPOGFMJ-UHFFFAOYSA-N
XLogP0.39
TPSA68.37 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.22
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(4-methoxy-2-methyl-3-pyridinyl)ethanol?
The IUPAC name of 2-amino-1-(4-methoxy-2-methyl-3-pyridinyl)ethanol (CID 84658495) is 2-amino-1-(4-methoxy-2-methyl-3-pyridinyl)ethanol.
What is the SMILES notation for 2-amino-1-(4-methoxy-2-methyl-3-pyridinyl)ethanol?
The canonical SMILES for 2-amino-1-(4-methoxy-2-methyl-3-pyridinyl)ethanol is COc1ccnc(C)c1C(O)CN.
What is the InChIKey of 2-amino-1-(4-methoxy-2-methyl-3-pyridinyl)ethanol?
The InChIKey is FULNTMJXPOGFMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O2/c1-6-9(7(12)5-10)8(13-2)3-4-11-6/h3-4,7,12H,5,10H2,1-2H3.
What are the key properties of 2-amino-1-(4-methoxy-2-methyl-3-pyridinyl)ethanol?
2-amino-1-(4-methoxy-2-methyl-3-pyridinyl)ethanol has a molecular weight of 182.22 g/mol, XLogP of 0.39, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(4-methoxy-2-methyl-3-pyridinyl)ethanol is sourced from PubChem (CID 84658495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).