2,2-difluoro-N,N-di(propan-2-yl)acetamide

C8H15F2NO — CID 14928300

IUPAC2,2-difluoro-N,N-di(propan-2-yl)acetamide
SMILESCC(C)N(C(=O)C(F)F)C(C)C
InChIInChI=1S/C8H15F2NO/c1-5(2)11(6(3)4)8(12)7(9)10/h5-7H,1-4H3
InChIKeyLKRYRDZWKNFVLV-UHFFFAOYSA-N
MW179.21 g/mol
LogP1.90
Rot. Bonds3

About 2,2-difluoro-N,N-di(propan-2-yl)acetamide

2,2-difluoro-N,N-di(propan-2-yl)acetamide (PubChem CID 14928300) has the molecular formula C8H15F2NO and a molecular weight of 179.21 g/mol. Its IUPAC name is 2,2-difluoro-N,N-di(propan-2-yl)acetamide.

Molecular Properties

Compound Name2,2-difluoro-N,N-di(propan-2-yl)acetamide
PubChem CID14928300
Molecular FormulaC8H15F2NO
Molecular Weight179.21 g/mol
Exact Mass179.11
IUPAC Name2,2-difluoro-N,N-di(propan-2-yl)acetamide
SMILESCC(C)N(C(=O)C(F)F)C(C)C
InChIInChI=1S/C8H15F2NO/c1-5(2)11(6(3)4)8(12)7(9)10/h5-7H,1-4H3
InChIKeyLKRYRDZWKNFVLV-UHFFFAOYSA-N
XLogP1.90
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.21
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N,N-Diisopropylacetamide
CID 69797
N,N-Diethyl-2,2,2-trifluoroacetamide
CID 225443
N,N-Dibutyl-2,2,2-trifluoroacetamide
CID 307195
N-Methyl-N-n-butyltrifluoroacetamide
CID 587692
Acetic acid, trifluoro, N,N-dipropyl
CID 524010
N-[5-(dimethylamino)pent-3-yn-2-yl]-2,2,2-trifluoro-N-methylacetamide
CID 14025461
Trimethyl-[4-[methyl-(2,2,2-trifluoroacetyl)amino]pent-2-ynyl]azanium
CID 14025469
Propanamide, 3,3,3-trifluoro-N,N-bis(1-methylethyl)-2-(trifluoromethyl)-
CID 613647
N,N-Diethyl-2,2-difluoroacetamide
CID 12557633
N,N-Diethyl-3,3,3-trifluoropropanamide
CID 14383591
N-cyclopentyl-2,2,2-trifluoro-N-methylacetamide
CID 63374781
N-t-butyl(dimethyl)-N-methyl-trifluoroacetamide
CID 87957890

Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-N,N-di(propan-2-yl)acetamide?
The IUPAC name of 2,2-difluoro-N,N-di(propan-2-yl)acetamide (CID 14928300) is 2,2-difluoro-N,N-di(propan-2-yl)acetamide.
What is the SMILES notation for 2,2-difluoro-N,N-di(propan-2-yl)acetamide?
The canonical SMILES for 2,2-difluoro-N,N-di(propan-2-yl)acetamide is CC(C)N(C(=O)C(F)F)C(C)C.
What is the InChIKey of 2,2-difluoro-N,N-di(propan-2-yl)acetamide?
The InChIKey is LKRYRDZWKNFVLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15F2NO/c1-5(2)11(6(3)4)8(12)7(9)10/h5-7H,1-4H3.
What are the key properties of 2,2-difluoro-N,N-di(propan-2-yl)acetamide?
2,2-difluoro-N,N-di(propan-2-yl)acetamide has a molecular weight of 179.21 g/mol, XLogP of 1.90, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-N,N-di(propan-2-yl)acetamide is sourced from PubChem (CID 14928300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).