2-[[ethyl(1-methoxypropan-2-yl)amino]methyl]-6-methylpyridin-3-ol

C13H22N2O2 — CID 82981586

IUPAC2-[[ethyl(1-methoxypropan-2-yl)amino]methyl]-6-methylpyridin-3-ol
SMILESCCN(Cc1nc(C)ccc1O)C(C)COC
InChIInChI=1S/C13H22N2O2/c1-5-15(11(3)9-17-4)8-12-13(16)7-6-10(2)14-12/h6-7,11,16H,5,8-9H2,1-4H3
InChIKeySSWROPKHAHKZDL-UHFFFAOYSA-N
MW238.33 g/mol
LogP1.95
Rot. Bonds6

About 2-[[ethyl(1-methoxypropan-2-yl)amino]methyl]-6-methylpyridin-3-ol

2-[[ethyl(1-methoxypropan-2-yl)amino]methyl]-6-methylpyridin-3-ol (PubChem CID 82981586) has the molecular formula C13H22N2O2 and a molecular weight of 238.33 g/mol. Its IUPAC name is 2-[[ethyl(1-methoxypropan-2-yl)amino]methyl]-6-methylpyridin-3-ol.

Molecular Properties

Compound Name2-[[ethyl(1-methoxypropan-2-yl)amino]methyl]-6-methylpyridin-3-ol
PubChem CID82981586
Molecular FormulaC13H22N2O2
Molecular Weight238.33 g/mol
Exact Mass238.17
IUPAC Name2-[[ethyl(1-methoxypropan-2-yl)amino]methyl]-6-methylpyridin-3-ol
SMILESCCN(Cc1nc(C)ccc1O)C(C)COC
InChIInChI=1S/C13H22N2O2/c1-5-15(11(3)9-17-4)8-12-13(16)7-6-10(2)14-12/h6-7,11,16H,5,8-9H2,1-4H3
InChIKeySSWROPKHAHKZDL-UHFFFAOYSA-N
XLogP1.95
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[[ethyl(1-methoxypropan-2-yl)amino]methyl]-6-methylpyridin-3-ol?
The IUPAC name of 2-[[ethyl(1-methoxypropan-2-yl)amino]methyl]-6-methylpyridin-3-ol (CID 82981586) is 2-[[ethyl(1-methoxypropan-2-yl)amino]methyl]-6-methylpyridin-3-ol.
What is the SMILES notation for 2-[[ethyl(1-methoxypropan-2-yl)amino]methyl]-6-methylpyridin-3-ol?
The canonical SMILES for 2-[[ethyl(1-methoxypropan-2-yl)amino]methyl]-6-methylpyridin-3-ol is CCN(Cc1nc(C)ccc1O)C(C)COC.
What is the InChIKey of 2-[[ethyl(1-methoxypropan-2-yl)amino]methyl]-6-methylpyridin-3-ol?
The InChIKey is SSWROPKHAHKZDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O2/c1-5-15(11(3)9-17-4)8-12-13(16)7-6-10(2)14-12/h6-7,11,16H,5,8-9H2,1-4H3.
What are the key properties of 2-[[ethyl(1-methoxypropan-2-yl)amino]methyl]-6-methylpyridin-3-ol?
2-[[ethyl(1-methoxypropan-2-yl)amino]methyl]-6-methylpyridin-3-ol has a molecular weight of 238.33 g/mol, XLogP of 1.95, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[ethyl(1-methoxypropan-2-yl)amino]methyl]-6-methylpyridin-3-ol is sourced from PubChem (CID 82981586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).