[4-[4-(hydroxymethyl)-3-pyridinyl]morpholin-3-yl]methanol

C11H16N2O3 — CID 105066985

IUPAC[4-[4-(hydroxymethyl)-3-pyridinyl]morpholin-3-yl]methanol
SMILESOCc1ccncc1N1CCOCC1CO
InChIInChI=1S/C11H16N2O3/c14-6-9-1-2-12-5-11(9)13-3-4-16-8-10(13)7-15/h1-2,5,10,14-15H,3-4,6-8H2
InChIKeyPPZJIMNGBIKUSP-UHFFFAOYSA-N
MW224.26 g/mol
LogP-0.23
Rot. Bonds3

About [4-[4-(hydroxymethyl)-3-pyridinyl]morpholin-3-yl]methanol

[4-[4-(hydroxymethyl)-3-pyridinyl]morpholin-3-yl]methanol (PubChem CID 105066985) has the molecular formula C11H16N2O3 and a molecular weight of 224.26 g/mol. Its IUPAC name is [4-[4-(hydroxymethyl)-3-pyridinyl]morpholin-3-yl]methanol.

Molecular Properties

Compound Name[4-[4-(hydroxymethyl)-3-pyridinyl]morpholin-3-yl]methanol
PubChem CID105066985
Molecular FormulaC11H16N2O3
Molecular Weight224.26 g/mol
Exact Mass224.12
IUPAC Name[4-[4-(hydroxymethyl)-3-pyridinyl]morpholin-3-yl]methanol
SMILESOCc1ccncc1N1CCOCC1CO
InChIInChI=1S/C11H16N2O3/c14-6-9-1-2-12-5-11(9)13-3-4-16-8-10(13)7-15/h1-2,5,10,14-15H,3-4,6-8H2
InChIKeyPPZJIMNGBIKUSP-UHFFFAOYSA-N
XLogP-0.23
TPSA65.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 5-0.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [4-[4-(hydroxymethyl)-3-pyridinyl]morpholin-3-yl]methanol?
The IUPAC name of [4-[4-(hydroxymethyl)-3-pyridinyl]morpholin-3-yl]methanol (CID 105066985) is [4-[4-(hydroxymethyl)-3-pyridinyl]morpholin-3-yl]methanol.
What is the SMILES notation for [4-[4-(hydroxymethyl)-3-pyridinyl]morpholin-3-yl]methanol?
The canonical SMILES for [4-[4-(hydroxymethyl)-3-pyridinyl]morpholin-3-yl]methanol is OCc1ccncc1N1CCOCC1CO.
What is the InChIKey of [4-[4-(hydroxymethyl)-3-pyridinyl]morpholin-3-yl]methanol?
The InChIKey is PPZJIMNGBIKUSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O3/c14-6-9-1-2-12-5-11(9)13-3-4-16-8-10(13)7-15/h1-2,5,10,14-15H,3-4,6-8H2.
What are the key properties of [4-[4-(hydroxymethyl)-3-pyridinyl]morpholin-3-yl]methanol?
[4-[4-(hydroxymethyl)-3-pyridinyl]morpholin-3-yl]methanol has a molecular weight of 224.26 g/mol, XLogP of -0.23, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[4-(hydroxymethyl)-3-pyridinyl]morpholin-3-yl]methanol is sourced from PubChem (CID 105066985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).