(3-amino-4-fluorocyclopentyl)methanol

C6H12FNO — CID 85144585

IUPAC(3-amino-4-fluorocyclopentyl)methanol
SMILESNC1CC(CO)CC1F
InChIInChI=1S/C6H12FNO/c7-5-1-4(3-9)2-6(5)8/h4-6,9H,1-3,8H2
InChIKeyCMPNENMBOKEGCY-UHFFFAOYSA-N
MW133.17 g/mol
LogP0.05
Rot. Bonds1

About (3-amino-4-fluorocyclopentyl)methanol

(3-amino-4-fluorocyclopentyl)methanol (PubChem CID 85144585) has the molecular formula C6H12FNO and a molecular weight of 133.17 g/mol. Its IUPAC name is (3-amino-4-fluorocyclopentyl)methanol.

Molecular Properties

Compound Name(3-amino-4-fluorocyclopentyl)methanol
PubChem CID85144585
Molecular FormulaC6H12FNO
Molecular Weight133.17 g/mol
Exact Mass133.09
IUPAC Name(3-amino-4-fluorocyclopentyl)methanol
SMILESNC1CC(CO)CC1F
InChIInChI=1S/C6H12FNO/c7-5-1-4(3-9)2-6(5)8/h4-6,9H,1-3,8H2
InChIKeyCMPNENMBOKEGCY-UHFFFAOYSA-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 (3-amino-4-fluorocyclopentyl)methanol?
The IUPAC name of (3-amino-4-fluorocyclopentyl)methanol (CID 85144585) is (3-amino-4-fluorocyclopentyl)methanol.
What is the SMILES notation for (3-amino-4-fluorocyclopentyl)methanol?
The canonical SMILES for (3-amino-4-fluorocyclopentyl)methanol is NC1CC(CO)CC1F.
What is the InChIKey of (3-amino-4-fluorocyclopentyl)methanol?
The InChIKey is CMPNENMBOKEGCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12FNO/c7-5-1-4(3-9)2-6(5)8/h4-6,9H,1-3,8H2.
What are the key properties of (3-amino-4-fluorocyclopentyl)methanol?
(3-amino-4-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 (3-amino-4-fluorocyclopentyl)methanol is sourced from PubChem (CID 85144585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).