2-(difluoromethoxy)-N,N-dimethylethanamine

C5H11F2NO — CID 122581358

IUPAC2-(difluoromethoxy)-N,N-dimethylethanamine
SMILESCN(C)CCOC(F)F
InChIInChI=1S/C5H11F2NO/c1-8(2)3-4-9-5(6)7/h5H,3-4H2,1-2H3
InChIKeyFCKPWUWBBMNCDD-UHFFFAOYSA-N
MW139.15 g/mol
LogP0.79
Rot. Bonds4

About 2-(difluoromethoxy)-N,N-dimethylethanamine

2-(difluoromethoxy)-N,N-dimethylethanamine (PubChem CID 122581358) has the molecular formula C5H11F2NO and a molecular weight of 139.15 g/mol. Its IUPAC name is 2-(difluoromethoxy)-N,N-dimethylethanamine.

Molecular Properties

Compound Name2-(difluoromethoxy)-N,N-dimethylethanamine
PubChem CID122581358
Molecular FormulaC5H11F2NO
Molecular Weight139.15 g/mol
Exact Mass139.08
IUPAC Name2-(difluoromethoxy)-N,N-dimethylethanamine
SMILESCN(C)CCOC(F)F
InChIInChI=1S/C5H11F2NO/c1-8(2)3-4-9-5(6)7/h5H,3-4H2,1-2H3
InChIKeyFCKPWUWBBMNCDD-UHFFFAOYSA-N
XLogP0.79
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.15
LogP ≤ 50.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethoxy)-N,N-dimethylethanamine?
The IUPAC name of 2-(difluoromethoxy)-N,N-dimethylethanamine (CID 122581358) is 2-(difluoromethoxy)-N,N-dimethylethanamine.
What is the SMILES notation for 2-(difluoromethoxy)-N,N-dimethylethanamine?
The canonical SMILES for 2-(difluoromethoxy)-N,N-dimethylethanamine is CN(C)CCOC(F)F.
What is the InChIKey of 2-(difluoromethoxy)-N,N-dimethylethanamine?
The InChIKey is FCKPWUWBBMNCDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11F2NO/c1-8(2)3-4-9-5(6)7/h5H,3-4H2,1-2H3.
What are the key properties of 2-(difluoromethoxy)-N,N-dimethylethanamine?
2-(difluoromethoxy)-N,N-dimethylethanamine has a molecular weight of 139.15 g/mol, XLogP of 0.79, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethoxy)-N,N-dimethylethanamine is sourced from PubChem (CID 122581358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).