methanol;4-[(5-pyridin-3-ylthiophen-2-yl)methyl]morpholine

C15H20N2O2S — CID 144647017

IUPACmethanol;4-[(5-pyridin-3-ylthiophen-2-yl)methyl]morpholine
SMILESCO.c1cncc(-c2ccc(CN3CCOCC3)s2)c1
InChIInChI=1S/C14H16N2OS.CH4O/c1-2-12(10-15-5-1)14-4-3-13(18-14)11-16-6-8-17-9-7-16;1-2/h1-5,10H,6-9,11H2;2H,1H3
InChIKeyFTMZNUQOVSBSMP-UHFFFAOYSA-N
MW292.40 g/mol
LogP2.25
Rot. Bonds3

About methanol;4-[(5-pyridin-3-ylthiophen-2-yl)methyl]morpholine

methanol;4-[(5-pyridin-3-ylthiophen-2-yl)methyl]morpholine (PubChem CID 144647017) has the molecular formula C15H20N2O2S and a molecular weight of 292.40 g/mol. Its IUPAC name is methanol;4-[(5-pyridin-3-ylthiophen-2-yl)methyl]morpholine.

Molecular Properties

Compound Namemethanol;4-[(5-pyridin-3-ylthiophen-2-yl)methyl]morpholine
PubChem CID144647017
Molecular FormulaC15H20N2O2S
Molecular Weight292.40 g/mol
Exact Mass292.12
IUPAC Namemethanol;4-[(5-pyridin-3-ylthiophen-2-yl)methyl]morpholine
SMILESCO.c1cncc(-c2ccc(CN3CCOCC3)s2)c1
InChIInChI=1S/C14H16N2OS.CH4O/c1-2-12(10-15-5-1)14-4-3-13(18-14)11-16-6-8-17-9-7-16;1-2/h1-5,10H,6-9,11H2;2H,1H3
InChIKeyFTMZNUQOVSBSMP-UHFFFAOYSA-N
XLogP2.25
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.40
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of methanol;4-[(5-pyridin-3-ylthiophen-2-yl)methyl]morpholine?
The IUPAC name of methanol;4-[(5-pyridin-3-ylthiophen-2-yl)methyl]morpholine (CID 144647017) is methanol;4-[(5-pyridin-3-ylthiophen-2-yl)methyl]morpholine.
What is the SMILES notation for methanol;4-[(5-pyridin-3-ylthiophen-2-yl)methyl]morpholine?
The canonical SMILES for methanol;4-[(5-pyridin-3-ylthiophen-2-yl)methyl]morpholine is CO.c1cncc(-c2ccc(CN3CCOCC3)s2)c1.
What is the InChIKey of methanol;4-[(5-pyridin-3-ylthiophen-2-yl)methyl]morpholine?
The InChIKey is FTMZNUQOVSBSMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2OS.CH4O/c1-2-12(10-15-5-1)14-4-3-13(18-14)11-16-6-8-17-9-7-16;1-2/h1-5,10H,6-9,11H2;2H,1H3.
What are the key properties of methanol;4-[(5-pyridin-3-ylthiophen-2-yl)methyl]morpholine?
methanol;4-[(5-pyridin-3-ylthiophen-2-yl)methyl]morpholine has a molecular weight of 292.40 g/mol, XLogP of 2.25, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methanol;4-[(5-pyridin-3-ylthiophen-2-yl)methyl]morpholine is sourced from PubChem (CID 144647017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).