2,2-difluoro-N,N-bis(2-methoxyethyl)propanamide

C9H17F2NO3 — CID 10922182

IUPAC2,2-difluoro-N,N-bis(2-methoxyethyl)propanamide
SMILESCOCCN(CCOC)C(=O)C(C)(F)F
InChIInChI=1S/C9H17F2NO3/c1-9(10,11)8(13)12(4-6-14-2)5-7-15-3/h4-7H2,1-3H3
InChIKeyVHCMZTOOHLKEMX-UHFFFAOYSA-N
MW225.23 g/mol
LogP0.76
Rot. Bonds7

About 2,2-difluoro-N,N-bis(2-methoxyethyl)propanamide

2,2-difluoro-N,N-bis(2-methoxyethyl)propanamide (PubChem CID 10922182) has the molecular formula C9H17F2NO3 and a molecular weight of 225.23 g/mol. Its IUPAC name is 2,2-difluoro-N,N-bis(2-methoxyethyl)propanamide.

Molecular Properties

Compound Name2,2-difluoro-N,N-bis(2-methoxyethyl)propanamide
PubChem CID10922182
Molecular FormulaC9H17F2NO3
Molecular Weight225.23 g/mol
Exact Mass225.12
IUPAC Name2,2-difluoro-N,N-bis(2-methoxyethyl)propanamide
SMILESCOCCN(CCOC)C(=O)C(C)(F)F
InChIInChI=1S/C9H17F2NO3/c1-9(10,11)8(13)12(4-6-14-2)5-7-15-3/h4-7H2,1-3H3
InChIKeyVHCMZTOOHLKEMX-UHFFFAOYSA-N
XLogP0.76
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.23
LogP ≤ 50.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-N,N-bis(2-methoxyethyl)propanamide?
The IUPAC name of 2,2-difluoro-N,N-bis(2-methoxyethyl)propanamide (CID 10922182) is 2,2-difluoro-N,N-bis(2-methoxyethyl)propanamide.
What is the SMILES notation for 2,2-difluoro-N,N-bis(2-methoxyethyl)propanamide?
The canonical SMILES for 2,2-difluoro-N,N-bis(2-methoxyethyl)propanamide is COCCN(CCOC)C(=O)C(C)(F)F.
What is the InChIKey of 2,2-difluoro-N,N-bis(2-methoxyethyl)propanamide?
The InChIKey is VHCMZTOOHLKEMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17F2NO3/c1-9(10,11)8(13)12(4-6-14-2)5-7-15-3/h4-7H2,1-3H3.
What are the key properties of 2,2-difluoro-N,N-bis(2-methoxyethyl)propanamide?
2,2-difluoro-N,N-bis(2-methoxyethyl)propanamide has a molecular weight of 225.23 g/mol, XLogP of 0.76, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-N,N-bis(2-methoxyethyl)propanamide is sourced from PubChem (CID 10922182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).