2-decyl-2-methylmorpholin-3-one;hydrochloride

C15H30ClNO2 — CID 175348948

IUPAC2-decyl-2-methylmorpholin-3-one;hydrochloride
SMILESCCCCCCCCCCC1(C)OCCNC1=O.Cl
InChIInChI=1S/C15H29NO2.ClH/c1-3-4-5-6-7-8-9-10-11-15(2)14(17)16-12-13-18-15;/h3-13H2,1-2H3,(H,16,17);1H
InChIKeyWXFNMMXKNBGPRC-UHFFFAOYSA-N
MW291.86 g/mol
LogP3.84
Rot. Bonds9

About 2-decyl-2-methylmorpholin-3-one;hydrochloride

2-decyl-2-methylmorpholin-3-one;hydrochloride (PubChem CID 175348948) has the molecular formula C15H30ClNO2 and a molecular weight of 291.86 g/mol. Its IUPAC name is 2-decyl-2-methylmorpholin-3-one;hydrochloride.

Molecular Properties

Compound Name2-decyl-2-methylmorpholin-3-one;hydrochloride
PubChem CID175348948
Molecular FormulaC15H30ClNO2
Molecular Weight291.86 g/mol
Exact Mass291.20
IUPAC Name2-decyl-2-methylmorpholin-3-one;hydrochloride
SMILESCCCCCCCCCCC1(C)OCCNC1=O.Cl
InChIInChI=1S/C15H29NO2.ClH/c1-3-4-5-6-7-8-9-10-11-15(2)14(17)16-12-13-18-15;/h3-13H2,1-2H3,(H,16,17);1H
InChIKeyWXFNMMXKNBGPRC-UHFFFAOYSA-N
XLogP3.84
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.86
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 2-decyl-2-methylmorpholin-3-one;hydrochloride?
The IUPAC name of 2-decyl-2-methylmorpholin-3-one;hydrochloride (CID 175348948) is 2-decyl-2-methylmorpholin-3-one;hydrochloride.
What is the SMILES notation for 2-decyl-2-methylmorpholin-3-one;hydrochloride?
The canonical SMILES for 2-decyl-2-methylmorpholin-3-one;hydrochloride is CCCCCCCCCCC1(C)OCCNC1=O.Cl.
What is the InChIKey of 2-decyl-2-methylmorpholin-3-one;hydrochloride?
The InChIKey is WXFNMMXKNBGPRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO2.ClH/c1-3-4-5-6-7-8-9-10-11-15(2)14(17)16-12-13-18-15;/h3-13H2,1-2H3,(H,16,17);1H.
What are the key properties of 2-decyl-2-methylmorpholin-3-one;hydrochloride?
2-decyl-2-methylmorpholin-3-one;hydrochloride has a molecular weight of 291.86 g/mol, XLogP of 3.84, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-decyl-2-methylmorpholin-3-one;hydrochloride is sourced from PubChem (CID 175348948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).