5,5-difluoropentanamide

C5H9F2NO — CID 87189781

IUPAC5,5-difluoropentanamide
SMILESNC(=O)CCCC(F)F
InChIInChI=1S/C5H9F2NO/c6-4(7)2-1-3-5(8)9/h4H,1-3H2,(H2,8,9)
InChIKeyDVZKVRSNIDQIBV-UHFFFAOYSA-N
MW137.13 g/mol
LogP0.91
Rot. Bonds4

About 5,5-difluoropentanamide

5,5-difluoropentanamide (PubChem CID 87189781) has the molecular formula C5H9F2NO and a molecular weight of 137.13 g/mol. Its IUPAC name is 5,5-difluoropentanamide.

Molecular Properties

Compound Name5,5-difluoropentanamide
PubChem CID87189781
Molecular FormulaC5H9F2NO
Molecular Weight137.13 g/mol
Exact Mass137.07
IUPAC Name5,5-difluoropentanamide
SMILESNC(=O)CCCC(F)F
InChIInChI=1S/C5H9F2NO/c6-4(7)2-1-3-5(8)9/h4H,1-3H2,(H2,8,9)
InChIKeyDVZKVRSNIDQIBV-UHFFFAOYSA-N
XLogP0.91
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.13
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,2,3,3,4,4,5,5-Octafluoropentanamide
CID 2063303
4,4,4-Trifluorobutanamide
CID 1272518
Hexanamide, 6-fluoro-
CID 12667
4,4,5,5,5-Pentafluoropentanamide
CID 54092366
N-(trifluoromethyl)pentanamide
CID 21660037
(2S,3R)-2,3-difluorohexanamide
CID 155931762
7,7,7-Trifluoroheptanamide
CID 166439060
3,4,4-Trifluorobutanamide
CID 18376727
N,2,2-trifluorohexanamide
CID 21140245
2,5-Difluoropentanamide
CID 21899023
N,2,2-trifluoropentanamide
CID 22216352
5-Fluoropentanamide
CID 53961116

Frequently Asked Questions

What is the IUPAC name of 5,5-difluoropentanamide?
The IUPAC name of 5,5-difluoropentanamide (CID 87189781) is 5,5-difluoropentanamide.
What is the SMILES notation for 5,5-difluoropentanamide?
The canonical SMILES for 5,5-difluoropentanamide is NC(=O)CCCC(F)F.
What is the InChIKey of 5,5-difluoropentanamide?
The InChIKey is DVZKVRSNIDQIBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9F2NO/c6-4(7)2-1-3-5(8)9/h4H,1-3H2,(H2,8,9).
What are the key properties of 5,5-difluoropentanamide?
5,5-difluoropentanamide has a molecular weight of 137.13 g/mol, XLogP of 0.91, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-difluoropentanamide is sourced from PubChem (CID 87189781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).