[4-[5-(hydroxymethyl)pyrazin-2-yl]-6-methylmorpholin-2-yl]methanol

C11H17N3O3 — CID 107372998

IUPAC[4-[5-(hydroxymethyl)pyrazin-2-yl]-6-methylmorpholin-2-yl]methanol
SMILESCC1CN(c2cnc(CO)cn2)CC(CO)O1
InChIInChI=1S/C11H17N3O3/c1-8-4-14(5-10(7-16)17-8)11-3-12-9(6-15)2-13-11/h2-3,8,10,15-16H,4-7H2,1H3
InChIKeyCMOTVBLGMRJAKY-UHFFFAOYSA-N
MW239.27 g/mol
LogP-0.45
Rot. Bonds3

About [4-[5-(hydroxymethyl)pyrazin-2-yl]-6-methylmorpholin-2-yl]methanol

[4-[5-(hydroxymethyl)pyrazin-2-yl]-6-methylmorpholin-2-yl]methanol (PubChem CID 107372998) has the molecular formula C11H17N3O3 and a molecular weight of 239.27 g/mol. Its IUPAC name is [4-[5-(hydroxymethyl)pyrazin-2-yl]-6-methylmorpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-[5-(hydroxymethyl)pyrazin-2-yl]-6-methylmorpholin-2-yl]methanol
PubChem CID107372998
Molecular FormulaC11H17N3O3
Molecular Weight239.27 g/mol
Exact Mass239.13
IUPAC Name[4-[5-(hydroxymethyl)pyrazin-2-yl]-6-methylmorpholin-2-yl]methanol
SMILESCC1CN(c2cnc(CO)cn2)CC(CO)O1
InChIInChI=1S/C11H17N3O3/c1-8-4-14(5-10(7-16)17-8)11-3-12-9(6-15)2-13-11/h2-3,8,10,15-16H,4-7H2,1H3
InChIKeyCMOTVBLGMRJAKY-UHFFFAOYSA-N
XLogP-0.45
TPSA78.71 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 5-0.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [4-[5-(hydroxymethyl)pyrazin-2-yl]-6-methylmorpholin-2-yl]methanol?
The IUPAC name of [4-[5-(hydroxymethyl)pyrazin-2-yl]-6-methylmorpholin-2-yl]methanol (CID 107372998) is [4-[5-(hydroxymethyl)pyrazin-2-yl]-6-methylmorpholin-2-yl]methanol.
What is the SMILES notation for [4-[5-(hydroxymethyl)pyrazin-2-yl]-6-methylmorpholin-2-yl]methanol?
The canonical SMILES for [4-[5-(hydroxymethyl)pyrazin-2-yl]-6-methylmorpholin-2-yl]methanol is CC1CN(c2cnc(CO)cn2)CC(CO)O1.
What is the InChIKey of [4-[5-(hydroxymethyl)pyrazin-2-yl]-6-methylmorpholin-2-yl]methanol?
The InChIKey is CMOTVBLGMRJAKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O3/c1-8-4-14(5-10(7-16)17-8)11-3-12-9(6-15)2-13-11/h2-3,8,10,15-16H,4-7H2,1H3.
What are the key properties of [4-[5-(hydroxymethyl)pyrazin-2-yl]-6-methylmorpholin-2-yl]methanol?
[4-[5-(hydroxymethyl)pyrazin-2-yl]-6-methylmorpholin-2-yl]methanol has a molecular weight of 239.27 g/mol, XLogP of -0.45, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[5-(hydroxymethyl)pyrazin-2-yl]-6-methylmorpholin-2-yl]methanol is sourced from PubChem (CID 107372998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).