[(1R,2S,4R)-4-amino-2-fluorocyclopentyl]methanol

C6H12FNO — CID 57116690

IUPAC[(1R,2S,4R)-4-amino-2-fluorocyclopentyl]methanol
SMILESN[C@@H]1C[C@H](CO)[C@@H](F)C1
InChIInChI=1S/C6H12FNO/c7-6-2-5(8)1-4(6)3-9/h4-6,9H,1-3,8H2/t4-,5-,6+/m1/s1
InChIKeyHJORJFAFLKABCY-PBXRRBTRSA-N
MW133.17 g/mol
LogP0.05
Rot. Bonds1

About [(1R,2S,4R)-4-amino-2-fluorocyclopentyl]methanol

[(1R,2S,4R)-4-amino-2-fluorocyclopentyl]methanol (PubChem CID 57116690) has the molecular formula C6H12FNO and a molecular weight of 133.17 g/mol. Its IUPAC name is [(1R,2S,4R)-4-amino-2-fluorocyclopentyl]methanol.

Molecular Properties

Compound Name[(1R,2S,4R)-4-amino-2-fluorocyclopentyl]methanol
PubChem CID57116690
Molecular FormulaC6H12FNO
Molecular Weight133.17 g/mol
Exact Mass133.09
IUPAC Name[(1R,2S,4R)-4-amino-2-fluorocyclopentyl]methanol
SMILESN[C@@H]1C[C@H](CO)[C@@H](F)C1
InChIInChI=1S/C6H12FNO/c7-6-2-5(8)1-4(6)3-9/h4-6,9H,1-3,8H2/t4-,5-,6+/m1/s1
InChIKeyHJORJFAFLKABCY-PBXRRBTRSA-N
XLogP0.05
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.17
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [(1R,2S,4R)-4-amino-2-fluorocyclopentyl]methanol?
The IUPAC name of [(1R,2S,4R)-4-amino-2-fluorocyclopentyl]methanol (CID 57116690) is [(1R,2S,4R)-4-amino-2-fluorocyclopentyl]methanol.
What is the SMILES notation for [(1R,2S,4R)-4-amino-2-fluorocyclopentyl]methanol?
The canonical SMILES for [(1R,2S,4R)-4-amino-2-fluorocyclopentyl]methanol is N[C@@H]1C[C@H](CO)[C@@H](F)C1.
What is the InChIKey of [(1R,2S,4R)-4-amino-2-fluorocyclopentyl]methanol?
The InChIKey is HJORJFAFLKABCY-PBXRRBTRSA-N. The full InChI is InChI=1S/C6H12FNO/c7-6-2-5(8)1-4(6)3-9/h4-6,9H,1-3,8H2/t4-,5-,6+/m1/s1.
What are the key properties of [(1R,2S,4R)-4-amino-2-fluorocyclopentyl]methanol?
[(1R,2S,4R)-4-amino-2-fluorocyclopentyl]methanol has a molecular weight of 133.17 g/mol, XLogP of 0.05, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R,2S,4R)-4-amino-2-fluorocyclopentyl]methanol is sourced from PubChem (CID 57116690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).