5-[2-(aminomethyl)-5-methylmorpholin-4-yl]pentan-1-ol

C11H24N2O2 — CID 81217514

IUPAC5-[2-(aminomethyl)-5-methylmorpholin-4-yl]pentan-1-ol
SMILESCC1COC(CN)CN1CCCCCO
InChIInChI=1S/C11H24N2O2/c1-10-9-15-11(7-12)8-13(10)5-3-2-4-6-14/h10-11,14H,2-9,12H2,1H3
InChIKeyCDLNXRQPGAIKIG-UHFFFAOYSA-N
MW216.32 g/mol
LogP0.20
Rot. Bonds6

About 5-[2-(aminomethyl)-5-methylmorpholin-4-yl]pentan-1-ol

5-[2-(aminomethyl)-5-methylmorpholin-4-yl]pentan-1-ol (PubChem CID 81217514) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is 5-[2-(aminomethyl)-5-methylmorpholin-4-yl]pentan-1-ol.

Molecular Properties

Compound Name5-[2-(aminomethyl)-5-methylmorpholin-4-yl]pentan-1-ol
PubChem CID81217514
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC Name5-[2-(aminomethyl)-5-methylmorpholin-4-yl]pentan-1-ol
SMILESCC1COC(CN)CN1CCCCCO
InChIInChI=1S/C11H24N2O2/c1-10-9-15-11(7-12)8-13(10)5-3-2-4-6-14/h10-11,14H,2-9,12H2,1H3
InChIKeyCDLNXRQPGAIKIG-UHFFFAOYSA-N
XLogP0.20
TPSA58.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 50.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-[2-(aminomethyl)-5-methylmorpholin-4-yl]pentan-1-ol?
The IUPAC name of 5-[2-(aminomethyl)-5-methylmorpholin-4-yl]pentan-1-ol (CID 81217514) is 5-[2-(aminomethyl)-5-methylmorpholin-4-yl]pentan-1-ol.
What is the SMILES notation for 5-[2-(aminomethyl)-5-methylmorpholin-4-yl]pentan-1-ol?
The canonical SMILES for 5-[2-(aminomethyl)-5-methylmorpholin-4-yl]pentan-1-ol is CC1COC(CN)CN1CCCCCO.
What is the InChIKey of 5-[2-(aminomethyl)-5-methylmorpholin-4-yl]pentan-1-ol?
The InChIKey is CDLNXRQPGAIKIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-10-9-15-11(7-12)8-13(10)5-3-2-4-6-14/h10-11,14H,2-9,12H2,1H3.
What are the key properties of 5-[2-(aminomethyl)-5-methylmorpholin-4-yl]pentan-1-ol?
5-[2-(aminomethyl)-5-methylmorpholin-4-yl]pentan-1-ol has a molecular weight of 216.32 g/mol, XLogP of 0.20, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(aminomethyl)-5-methylmorpholin-4-yl]pentan-1-ol is sourced from PubChem (CID 81217514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).