2-(difluoromethoxy)ethanamine;ethane

C5H13F2NO — CID 176962919

IUPAC2-(difluoromethoxy)ethanamine;ethane
SMILESCC.NCCOC(F)F
InChIInChI=1S/C3H7F2NO.C2H6/c4-3(5)7-2-1-6;1-2/h3H,1-2,6H2;1-2H3
InChIKeyWEDWGAXVKNLRKB-UHFFFAOYSA-N
MW141.16 g/mol
LogP1.21
Rot. Bonds3

About 2-(difluoromethoxy)ethanamine;ethane

2-(difluoromethoxy)ethanamine;ethane (PubChem CID 176962919) has the molecular formula C5H13F2NO and a molecular weight of 141.16 g/mol. Its IUPAC name is 2-(difluoromethoxy)ethanamine;ethane.

Molecular Properties

Compound Name2-(difluoromethoxy)ethanamine;ethane
PubChem CID176962919
Molecular FormulaC5H13F2NO
Molecular Weight141.16 g/mol
Exact Mass141.10
IUPAC Name2-(difluoromethoxy)ethanamine;ethane
SMILESCC.NCCOC(F)F
InChIInChI=1S/C3H7F2NO.C2H6/c4-3(5)7-2-1-6;1-2/h3H,1-2,6H2;1-2H3
InChIKeyWEDWGAXVKNLRKB-UHFFFAOYSA-N
XLogP1.21
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.16
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(difluoromethoxy)-2-fluoroethane
CID 87932237
2-propan-2-yloxyethanamine
CID 533866
1-(2-aminoethoxy)ethanol;hydroxylamine
CID 87972798
1-(difluoromethoxy)-3-methoxypropane
CID 59224265
1-(difluoromethoxy)-2-methylsulfanylethane
CID 122581351
1-(difluoromethoxy)decane
CID 14400535
1-chloro-2-(difluoromethoxy)ethane
CID 88775402
2-aminoethoxy(trihydroxy)phosphanium
CID 55290252
1-(2-aminoethoxy)propan-1-ol
CID 87147915
ethane;ethane-1,2-diamine;dihydrochloride
CID 168908211
2-aminoethoxy(ethoxy)methanol
CID 155706478
2-(1-methoxypropoxy)ethanamine
CID 147503736

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethoxy)ethanamine;ethane?
The IUPAC name of 2-(difluoromethoxy)ethanamine;ethane (CID 176962919) is 2-(difluoromethoxy)ethanamine;ethane.
What is the SMILES notation for 2-(difluoromethoxy)ethanamine;ethane?
The canonical SMILES for 2-(difluoromethoxy)ethanamine;ethane is CC.NCCOC(F)F.
What is the InChIKey of 2-(difluoromethoxy)ethanamine;ethane?
The InChIKey is WEDWGAXVKNLRKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7F2NO.C2H6/c4-3(5)7-2-1-6;1-2/h3H,1-2,6H2;1-2H3.
What are the key properties of 2-(difluoromethoxy)ethanamine;ethane?
2-(difluoromethoxy)ethanamine;ethane has a molecular weight of 141.16 g/mol, XLogP of 1.21, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethoxy)ethanamine;ethane is sourced from PubChem (CID 176962919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).