[6-(2-methoxypropylamino)-2-methyl-3-pyridinyl]methanol

C11H18N2O2 — CID 102700325

IUPAC[6-(2-methoxypropylamino)-2-methyl-3-pyridinyl]methanol
SMILESCOC(C)CNc1ccc(CO)c(C)n1
InChIInChI=1S/C11H18N2O2/c1-8(15-3)6-12-11-5-4-10(7-14)9(2)13-11/h4-5,8,14H,6-7H2,1-3H3,(H,12,13)
InChIKeyKHLXCHZCTPLIPC-UHFFFAOYSA-N
MW210.28 g/mol
LogP1.33
Rot. Bonds5

About [6-(2-methoxypropylamino)-2-methyl-3-pyridinyl]methanol

[6-(2-methoxypropylamino)-2-methyl-3-pyridinyl]methanol (PubChem CID 102700325) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is [6-(2-methoxypropylamino)-2-methyl-3-pyridinyl]methanol.

Molecular Properties

Compound Name[6-(2-methoxypropylamino)-2-methyl-3-pyridinyl]methanol
PubChem CID102700325
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name[6-(2-methoxypropylamino)-2-methyl-3-pyridinyl]methanol
SMILESCOC(C)CNc1ccc(CO)c(C)n1
InChIInChI=1S/C11H18N2O2/c1-8(15-3)6-12-11-5-4-10(7-14)9(2)13-11/h4-5,8,14H,6-7H2,1-3H3,(H,12,13)
InChIKeyKHLXCHZCTPLIPC-UHFFFAOYSA-N
XLogP1.33
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [6-(2-methoxypropylamino)-2-methyl-3-pyridinyl]methanol?
The IUPAC name of [6-(2-methoxypropylamino)-2-methyl-3-pyridinyl]methanol (CID 102700325) is [6-(2-methoxypropylamino)-2-methyl-3-pyridinyl]methanol.
What is the SMILES notation for [6-(2-methoxypropylamino)-2-methyl-3-pyridinyl]methanol?
The canonical SMILES for [6-(2-methoxypropylamino)-2-methyl-3-pyridinyl]methanol is COC(C)CNc1ccc(CO)c(C)n1.
What is the InChIKey of [6-(2-methoxypropylamino)-2-methyl-3-pyridinyl]methanol?
The InChIKey is KHLXCHZCTPLIPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-8(15-3)6-12-11-5-4-10(7-14)9(2)13-11/h4-5,8,14H,6-7H2,1-3H3,(H,12,13).
What are the key properties of [6-(2-methoxypropylamino)-2-methyl-3-pyridinyl]methanol?
[6-(2-methoxypropylamino)-2-methyl-3-pyridinyl]methanol has a molecular weight of 210.28 g/mol, XLogP of 1.33, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2-methoxypropylamino)-2-methyl-3-pyridinyl]methanol is sourced from PubChem (CID 102700325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).