[1-(aminomethyl)cyclopentyl]methanesulfonyl fluoride

C7H14FNO2S — CID 165446351

IUPAC[1-(aminomethyl)cyclopentyl]methanesulfonyl fluoride
SMILESNCC1(CS(=O)(=O)F)CCCC1
InChIInChI=1S/C7H14FNO2S/c8-12(10,11)6-7(5-9)3-1-2-4-7/h1-6,9H2
InChIKeyZKRLSQHFVNSUEL-UHFFFAOYSA-N
MW195.26 g/mol
LogP0.80
Rot. Bonds3

About [1-(aminomethyl)cyclopentyl]methanesulfonyl fluoride

[1-(aminomethyl)cyclopentyl]methanesulfonyl fluoride (PubChem CID 165446351) has the molecular formula C7H14FNO2S and a molecular weight of 195.26 g/mol. Its IUPAC name is [1-(aminomethyl)cyclopentyl]methanesulfonyl fluoride.

Molecular Properties

Compound Name[1-(aminomethyl)cyclopentyl]methanesulfonyl fluoride
PubChem CID165446351
Molecular FormulaC7H14FNO2S
Molecular Weight195.26 g/mol
Exact Mass195.07
IUPAC Name[1-(aminomethyl)cyclopentyl]methanesulfonyl fluoride
SMILESNCC1(CS(=O)(=O)F)CCCC1
InChIInChI=1S/C7H14FNO2S/c8-12(10,11)6-7(5-9)3-1-2-4-7/h1-6,9H2
InChIKeyZKRLSQHFVNSUEL-UHFFFAOYSA-N
XLogP0.80
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-(aminomethyl)cyclopentyl]methanesulfonyl fluoride?
The IUPAC name of [1-(aminomethyl)cyclopentyl]methanesulfonyl fluoride (CID 165446351) is [1-(aminomethyl)cyclopentyl]methanesulfonyl fluoride.
What is the SMILES notation for [1-(aminomethyl)cyclopentyl]methanesulfonyl fluoride?
The canonical SMILES for [1-(aminomethyl)cyclopentyl]methanesulfonyl fluoride is NCC1(CS(=O)(=O)F)CCCC1.
What is the InChIKey of [1-(aminomethyl)cyclopentyl]methanesulfonyl fluoride?
The InChIKey is ZKRLSQHFVNSUEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14FNO2S/c8-12(10,11)6-7(5-9)3-1-2-4-7/h1-6,9H2.
What are the key properties of [1-(aminomethyl)cyclopentyl]methanesulfonyl fluoride?
[1-(aminomethyl)cyclopentyl]methanesulfonyl fluoride has a molecular weight of 195.26 g/mol, XLogP of 0.80, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(aminomethyl)cyclopentyl]methanesulfonyl fluoride is sourced from PubChem (CID 165446351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).