4-[6-(methylamino)-2-pyridinyl]oxan-4-ol

C11H16N2O2 — CID 174613932

IUPAC4-[6-(methylamino)-2-pyridinyl]oxan-4-ol
SMILESCNc1cccc(C2(O)CCOCC2)n1
InChIInChI=1S/C11H16N2O2/c1-12-10-4-2-3-9(13-10)11(14)5-7-15-8-6-11/h2-4,14H,5-8H2,1H3,(H,12,13)
InChIKeyGGMPKIYYHZAYJK-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.12
Rot. Bonds2

About 4-[6-(methylamino)-2-pyridinyl]oxan-4-ol

4-[6-(methylamino)-2-pyridinyl]oxan-4-ol (PubChem CID 174613932) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 4-[6-(methylamino)-2-pyridinyl]oxan-4-ol.

Molecular Properties

Compound Name4-[6-(methylamino)-2-pyridinyl]oxan-4-ol
PubChem CID174613932
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name4-[6-(methylamino)-2-pyridinyl]oxan-4-ol
SMILESCNc1cccc(C2(O)CCOCC2)n1
InChIInChI=1S/C11H16N2O2/c1-12-10-4-2-3-9(13-10)11(14)5-7-15-8-6-11/h2-4,14H,5-8H2,1H3,(H,12,13)
InChIKeyGGMPKIYYHZAYJK-UHFFFAOYSA-N
XLogP1.12
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[6-(methylamino)-2-pyridinyl]oxan-4-ol?
The IUPAC name of 4-[6-(methylamino)-2-pyridinyl]oxan-4-ol (CID 174613932) is 4-[6-(methylamino)-2-pyridinyl]oxan-4-ol.
What is the SMILES notation for 4-[6-(methylamino)-2-pyridinyl]oxan-4-ol?
The canonical SMILES for 4-[6-(methylamino)-2-pyridinyl]oxan-4-ol is CNc1cccc(C2(O)CCOCC2)n1.
What is the InChIKey of 4-[6-(methylamino)-2-pyridinyl]oxan-4-ol?
The InChIKey is GGMPKIYYHZAYJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-12-10-4-2-3-9(13-10)11(14)5-7-15-8-6-11/h2-4,14H,5-8H2,1H3,(H,12,13).
What are the key properties of 4-[6-(methylamino)-2-pyridinyl]oxan-4-ol?
4-[6-(methylamino)-2-pyridinyl]oxan-4-ol has a molecular weight of 208.26 g/mol, XLogP of 1.12, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[6-(methylamino)-2-pyridinyl]oxan-4-ol is sourced from PubChem (CID 174613932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).