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

C8H15F2NO2 — CID 103513897

IUPACN-butyl-2,2-difluoro-N-(2-hydroxyethyl)acetamide
SMILESCCCCN(CCO)C(=O)C(F)F
InChIInChI=1S/C8H15F2NO2/c1-2-3-4-11(5-6-12)8(13)7(9)10/h7,12H,2-6H2,1H3
InChIKeyNOTQCJAAVLNHAX-UHFFFAOYSA-N
MW195.21 g/mol
LogP0.87
Rot. Bonds6

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

N-butyl-2,2-difluoro-N-(2-hydroxyethyl)acetamide (PubChem CID 103513897) has the molecular formula C8H15F2NO2 and a molecular weight of 195.21 g/mol. Its IUPAC name is N-butyl-2,2-difluoro-N-(2-hydroxyethyl)acetamide.

Molecular Properties

Compound NameN-butyl-2,2-difluoro-N-(2-hydroxyethyl)acetamide
PubChem CID103513897
Molecular FormulaC8H15F2NO2
Molecular Weight195.21 g/mol
Exact Mass195.11
IUPAC NameN-butyl-2,2-difluoro-N-(2-hydroxyethyl)acetamide
SMILESCCCCN(CCO)C(=O)C(F)F
InChIInChI=1S/C8H15F2NO2/c1-2-3-4-11(5-6-12)8(13)7(9)10/h7,12H,2-6H2,1H3
InChIKeyNOTQCJAAVLNHAX-UHFFFAOYSA-N
XLogP0.87
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.21
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,2-difluoro-N-(2-hydroxyethyl)-N-propylacetamide
CID 103513896
2,2-difluoro-N-(2-hydroxyethyl)-N-(2-methoxyethyl)acetamide
CID 103513987
N-butyl-N',N'-bis(2-hydroxyethyl)-N-propyloxamide
CID 108509852
1-butyl-1-(2-hydroxyethyl)-3-propan-2-ylurea
CID 60781183
2-amino-N-butyl-N-(2-hydroxyethyl)-2-phenylacetamide
CID 54870866
N,N-dibutyl-2-methylpentanamide
CID 2904869
N-butyl-N-(2-hydroxyethyl)-2-methoxyacetamide
CID 20697100
3-amino-N-butyl-N-(2-hydroxyethyl)-2-phenylpropanamide
CID 62878005
3-(ethylamino)-N-hexyl-N-(2-hydroxyethyl)-2-methylpropanamide
CID 62852561
5-amino-N-butyl-N-(2-hydroxyethyl)hexanamide
CID 82851620
(2R)-2-amino-N,N-dibutylpentanamide
CID 103793770
N,N-dibutyl-3-chloro-2-methylpropanamide
CID 62728082

Frequently Asked Questions

What is the IUPAC name of N-butyl-2,2-difluoro-N-(2-hydroxyethyl)acetamide?
The IUPAC name of N-butyl-2,2-difluoro-N-(2-hydroxyethyl)acetamide (CID 103513897) is N-butyl-2,2-difluoro-N-(2-hydroxyethyl)acetamide.
What is the SMILES notation for N-butyl-2,2-difluoro-N-(2-hydroxyethyl)acetamide?
The canonical SMILES for N-butyl-2,2-difluoro-N-(2-hydroxyethyl)acetamide is CCCCN(CCO)C(=O)C(F)F.
What is the InChIKey of N-butyl-2,2-difluoro-N-(2-hydroxyethyl)acetamide?
The InChIKey is NOTQCJAAVLNHAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15F2NO2/c1-2-3-4-11(5-6-12)8(13)7(9)10/h7,12H,2-6H2,1H3.
What are the key properties of N-butyl-2,2-difluoro-N-(2-hydroxyethyl)acetamide?
N-butyl-2,2-difluoro-N-(2-hydroxyethyl)acetamide has a molecular weight of 195.21 g/mol, XLogP of 0.87, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-2,2-difluoro-N-(2-hydroxyethyl)acetamide is sourced from PubChem (CID 103513897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).