2-methylmorpholine;hydrochloride

C5H12ClNO — CID 22605557

IUPAC2-methylmorpholine;hydrochloride
SMILESCC1CNCCO1.Cl
InChIInChI=1S/C5H11NO.ClH/c1-5-4-6-2-3-7-5;/h5-6H,2-4H2,1H3;1H
InChIKeyPJYFXNZOOMGPIL-UHFFFAOYSA-N
MW137.61 g/mol
LogP0.42
Rot. Bonds

About 2-methylmorpholine;hydrochloride

2-methylmorpholine;hydrochloride (PubChem CID 22605557) has the molecular formula C5H12ClNO and a molecular weight of 137.61 g/mol. Its IUPAC name is 2-methylmorpholine;hydrochloride.

Molecular Properties

Compound Name2-methylmorpholine;hydrochloride
PubChem CID22605557
Molecular FormulaC5H12ClNO
Molecular Weight137.61 g/mol
Exact Mass137.06
IUPAC Name2-methylmorpholine;hydrochloride
SMILESCC1CNCCO1.Cl
InChIInChI=1S/C5H11NO.ClH/c1-5-4-6-2-3-7-5;/h5-6H,2-4H2,1H3;1H
InChIKeyPJYFXNZOOMGPIL-UHFFFAOYSA-N
XLogP0.42
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.61
LogP ≤ 50.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methylmorpholine;hydrochloride?
The IUPAC name of 2-methylmorpholine;hydrochloride (CID 22605557) is 2-methylmorpholine;hydrochloride.
What is the SMILES notation for 2-methylmorpholine;hydrochloride?
The canonical SMILES for 2-methylmorpholine;hydrochloride is CC1CNCCO1.Cl.
What is the InChIKey of 2-methylmorpholine;hydrochloride?
The InChIKey is PJYFXNZOOMGPIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO.ClH/c1-5-4-6-2-3-7-5;/h5-6H,2-4H2,1H3;1H.
What are the key properties of 2-methylmorpholine;hydrochloride?
2-methylmorpholine;hydrochloride has a molecular weight of 137.61 g/mol, XLogP of 0.42, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylmorpholine;hydrochloride is sourced from PubChem (CID 22605557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).