N-[(1R,2R)-2-fluorocyclohexyl]cyclopropanesulfonamide

C9H16FNO2S — CID 126794067

IUPACN-[(1R,2R)-2-fluorocyclohexyl]cyclopropanesulfonamide
SMILESO=S(=O)(N[C@@H]1CCCC[C@H]1F)C1CC1
InChIInChI=1S/C9H16FNO2S/c10-8-3-1-2-4-9(8)11-14(12,13)7-5-6-7/h7-9,11H,1-6H2/t8-,9-/m1/s1
InChIKeyLFWGFCKKKRZOMY-RKDXNWHRSA-N
MW221.30 g/mol
LogP1.35
Rot. Bonds3

About N-[(1R,2R)-2-fluorocyclohexyl]cyclopropanesulfonamide

N-[(1R,2R)-2-fluorocyclohexyl]cyclopropanesulfonamide (PubChem CID 126794067) has the molecular formula C9H16FNO2S and a molecular weight of 221.30 g/mol. Its IUPAC name is N-[(1R,2R)-2-fluorocyclohexyl]cyclopropanesulfonamide.

Molecular Properties

Compound NameN-[(1R,2R)-2-fluorocyclohexyl]cyclopropanesulfonamide
PubChem CID126794067
Molecular FormulaC9H16FNO2S
Molecular Weight221.30 g/mol
Exact Mass221.09
IUPAC NameN-[(1R,2R)-2-fluorocyclohexyl]cyclopropanesulfonamide
SMILESO=S(=O)(N[C@@H]1CCCC[C@H]1F)C1CC1
InChIInChI=1S/C9H16FNO2S/c10-8-3-1-2-4-9(8)11-14(12,13)7-5-6-7/h7-9,11H,1-6H2/t8-,9-/m1/s1
InChIKeyLFWGFCKKKRZOMY-RKDXNWHRSA-N
XLogP1.35
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(1R,2R)-2-fluorocyclohexyl]cyclopropanesulfonamide?
The IUPAC name of N-[(1R,2R)-2-fluorocyclohexyl]cyclopropanesulfonamide (CID 126794067) is N-[(1R,2R)-2-fluorocyclohexyl]cyclopropanesulfonamide.
What is the SMILES notation for N-[(1R,2R)-2-fluorocyclohexyl]cyclopropanesulfonamide?
The canonical SMILES for N-[(1R,2R)-2-fluorocyclohexyl]cyclopropanesulfonamide is O=S(=O)(N[C@@H]1CCCC[C@H]1F)C1CC1.
What is the InChIKey of N-[(1R,2R)-2-fluorocyclohexyl]cyclopropanesulfonamide?
The InChIKey is LFWGFCKKKRZOMY-RKDXNWHRSA-N. The full InChI is InChI=1S/C9H16FNO2S/c10-8-3-1-2-4-9(8)11-14(12,13)7-5-6-7/h7-9,11H,1-6H2/t8-,9-/m1/s1.
What are the key properties of N-[(1R,2R)-2-fluorocyclohexyl]cyclopropanesulfonamide?
N-[(1R,2R)-2-fluorocyclohexyl]cyclopropanesulfonamide has a molecular weight of 221.30 g/mol, XLogP of 1.35, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R,2R)-2-fluorocyclohexyl]cyclopropanesulfonamide is sourced from PubChem (CID 126794067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).