N-(3-fluoropropylsulfonyl)acetamide

C5H10FNO3S — CID 131214902

IUPACN-(3-fluoropropylsulfonyl)acetamide
SMILESCC(=O)NS(=O)(=O)CCCF
InChIInChI=1S/C5H10FNO3S/c1-5(8)7-11(9,10)4-2-3-6/h2-4H2,1H3,(H,7,8)
InChIKeyIESFAOVWOQAKOW-UHFFFAOYSA-N
MW183.20 g/mol
LogP-0.19
Rot. Bonds4

About N-(3-fluoropropylsulfonyl)acetamide

N-(3-fluoropropylsulfonyl)acetamide (PubChem CID 131214902) has the molecular formula C5H10FNO3S and a molecular weight of 183.20 g/mol. Its IUPAC name is N-(3-fluoropropylsulfonyl)acetamide.

Molecular Properties

Compound NameN-(3-fluoropropylsulfonyl)acetamide
PubChem CID131214902
Molecular FormulaC5H10FNO3S
Molecular Weight183.20 g/mol
Exact Mass183.04
IUPAC NameN-(3-fluoropropylsulfonyl)acetamide
SMILESCC(=O)NS(=O)(=O)CCCF
InChIInChI=1S/C5H10FNO3S/c1-5(8)7-11(9,10)4-2-3-6/h2-4H2,1H3,(H,7,8)
InChIKeyIESFAOVWOQAKOW-UHFFFAOYSA-N
XLogP-0.19
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.20
LogP ≤ 5-0.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-fluoropropylsulfonyl)acetamide?
The IUPAC name of N-(3-fluoropropylsulfonyl)acetamide (CID 131214902) is N-(3-fluoropropylsulfonyl)acetamide.
What is the SMILES notation for N-(3-fluoropropylsulfonyl)acetamide?
The canonical SMILES for N-(3-fluoropropylsulfonyl)acetamide is CC(=O)NS(=O)(=O)CCCF.
What is the InChIKey of N-(3-fluoropropylsulfonyl)acetamide?
The InChIKey is IESFAOVWOQAKOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10FNO3S/c1-5(8)7-11(9,10)4-2-3-6/h2-4H2,1H3,(H,7,8).
What are the key properties of N-(3-fluoropropylsulfonyl)acetamide?
N-(3-fluoropropylsulfonyl)acetamide has a molecular weight of 183.20 g/mol, XLogP of -0.19, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluoropropylsulfonyl)acetamide is sourced from PubChem (CID 131214902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).