2,2-difluoro-N,N-bis(2-hydroxyethyl)acetamide

C6H11F2NO3 — CID 103513893

IUPAC2,2-difluoro-N,N-bis(2-hydroxyethyl)acetamide
SMILESO=C(C(F)F)N(CCO)CCO
InChIInChI=1S/C6H11F2NO3/c7-5(8)6(12)9(1-3-10)2-4-11/h5,10-11H,1-4H2
InChIKeyNTPRVAAQGKCNLZ-UHFFFAOYSA-N
MW183.15 g/mol
LogP-0.94
Rot. Bonds5

About 2,2-difluoro-N,N-bis(2-hydroxyethyl)acetamide

2,2-difluoro-N,N-bis(2-hydroxyethyl)acetamide (PubChem CID 103513893) has the molecular formula C6H11F2NO3 and a molecular weight of 183.15 g/mol. Its IUPAC name is 2,2-difluoro-N,N-bis(2-hydroxyethyl)acetamide.

Molecular Properties

Compound Name2,2-difluoro-N,N-bis(2-hydroxyethyl)acetamide
PubChem CID103513893
Molecular FormulaC6H11F2NO3
Molecular Weight183.15 g/mol
Exact Mass183.07
IUPAC Name2,2-difluoro-N,N-bis(2-hydroxyethyl)acetamide
SMILESO=C(C(F)F)N(CCO)CCO
InChIInChI=1S/C6H11F2NO3/c7-5(8)6(12)9(1-3-10)2-4-11/h5,10-11H,1-4H2
InChIKeyNTPRVAAQGKCNLZ-UHFFFAOYSA-N
XLogP-0.94
TPSA60.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.15
LogP ≤ 5-0.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-bis(2-hydroxyethyl)acetamide
CID 9793833
N-(2-hydroxyethyl)-N-methylacetamide
CID 10510843
N-methyl-N-trifluoroacetyl ethanoloamine
CID 57161818
N-Ethyl-2,2,2-trifluoro-N-(2-hydroxyethyl)acetamide
CID 60999971
Acetamide, N-methyl-N-(2-methoxyethyl)trifluoro-
CID 62728049
2,2,2-trifluoro-N-(2-hydroxyethyl)-N-propylacetamide
CID 61424901
N-butyl-2,2,2-trifluoro-N-(2-hydroxyethyl)acetamide
CID 61448362
N-(2-hydroxyethyl)-N-(2,2,2-trifluoroethyl)acetamide
CID 64590692
Acetamide, trifluoro-N-trifluoroacetyl-N-(2-hydroxyethyl)-
CID 91712836
2,2,3,3,3-Pentafluoro-N-(2-hydroxyethyl)-N-methylpropanamide
CID 91730500
N-Ethyl-2,2,3,3,3-pentafluoro-N-(2-hydroxyethyl)propanamide
CID 91733399
2,2,2-trifluoro-N,N-bis(2-hydroxyethyl)acetamide
CID 1925938

Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-N,N-bis(2-hydroxyethyl)acetamide?
The IUPAC name of 2,2-difluoro-N,N-bis(2-hydroxyethyl)acetamide (CID 103513893) is 2,2-difluoro-N,N-bis(2-hydroxyethyl)acetamide.
What is the SMILES notation for 2,2-difluoro-N,N-bis(2-hydroxyethyl)acetamide?
The canonical SMILES for 2,2-difluoro-N,N-bis(2-hydroxyethyl)acetamide is O=C(C(F)F)N(CCO)CCO.
What is the InChIKey of 2,2-difluoro-N,N-bis(2-hydroxyethyl)acetamide?
The InChIKey is NTPRVAAQGKCNLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11F2NO3/c7-5(8)6(12)9(1-3-10)2-4-11/h5,10-11H,1-4H2.
What are the key properties of 2,2-difluoro-N,N-bis(2-hydroxyethyl)acetamide?
2,2-difluoro-N,N-bis(2-hydroxyethyl)acetamide has a molecular weight of 183.15 g/mol, XLogP of -0.94, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-N,N-bis(2-hydroxyethyl)acetamide is sourced from PubChem (CID 103513893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).