2-(difluoromethyl)morpholine;hydrochloride

C5H10ClF2NO — CID 118280684

IUPAC2-(difluoromethyl)morpholine;hydrochloride
SMILESCl.FC(F)C1CNCCO1
InChIInChI=1S/C5H9F2NO.ClH/c6-5(7)4-3-8-1-2-9-4;/h4-5,8H,1-3H2;1H
InChIKeyQDWKZGSDPAPRRX-UHFFFAOYSA-N
MW173.59 g/mol
LogP0.66
Rot. Bonds1

About 2-(difluoromethyl)morpholine;hydrochloride

2-(difluoromethyl)morpholine;hydrochloride (PubChem CID 118280684) has the molecular formula C5H10ClF2NO and a molecular weight of 173.59 g/mol. Its IUPAC name is 2-(difluoromethyl)morpholine;hydrochloride.

Molecular Properties

Compound Name2-(difluoromethyl)morpholine;hydrochloride
PubChem CID118280684
Molecular FormulaC5H10ClF2NO
Molecular Weight173.59 g/mol
Exact Mass173.04
IUPAC Name2-(difluoromethyl)morpholine;hydrochloride
SMILESCl.FC(F)C1CNCCO1
InChIInChI=1S/C5H9F2NO.ClH/c6-5(7)4-3-8-1-2-9-4;/h4-5,8H,1-3H2;1H
InChIKeyQDWKZGSDPAPRRX-UHFFFAOYSA-N
XLogP0.66
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.59
LogP ≤ 50.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,6-Dimethylmorpholine
CID 110862
2,6-Dimethylmorpholine, cis-
CID 641500
trans-2,6-Dimethylmorpholine
CID 641501
2-Methylmorpholine
CID 410615
(2R)-2-methylmorpholine
CID 641497
2,6-Dimethylmorpholine, (2R,6R)-
CID 11137133
(2S)-2-Methylmorpholine
CID 36689624
3-(Difluoromethoxy)piperidine
CID 47003318
3-(2,2-Difluoroethyl)morpholine
CID 119030882
2-Methylmorpholine--hydrogen chloride (1/1)
CID 22605557
2-(Fluoromethyl)morpholine hydrochloride
CID 19777251
(2R)-2-Methylmorpholine hydrochloride
CID 42609645

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)morpholine;hydrochloride?
The IUPAC name of 2-(difluoromethyl)morpholine;hydrochloride (CID 118280684) is 2-(difluoromethyl)morpholine;hydrochloride.
What is the SMILES notation for 2-(difluoromethyl)morpholine;hydrochloride?
The canonical SMILES for 2-(difluoromethyl)morpholine;hydrochloride is Cl.FC(F)C1CNCCO1.
What is the InChIKey of 2-(difluoromethyl)morpholine;hydrochloride?
The InChIKey is QDWKZGSDPAPRRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9F2NO.ClH/c6-5(7)4-3-8-1-2-9-4;/h4-5,8H,1-3H2;1H.
What are the key properties of 2-(difluoromethyl)morpholine;hydrochloride?
2-(difluoromethyl)morpholine;hydrochloride has a molecular weight of 173.59 g/mol, XLogP of 0.66, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)morpholine;hydrochloride is sourced from PubChem (CID 118280684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).