(2S,3R)-2-fluoro-N-methyloxolan-3-amine

C5H10FNO — CID 118395136

IUPAC(2S,3R)-2-fluoro-N-methyloxolan-3-amine
SMILESCN[C@@H]1CCO[C@H]1F
InChIInChI=1S/C5H10FNO/c1-7-4-2-3-8-5(4)6/h4-5,7H,2-3H2,1H3/t4-,5-/m1/s1
InChIKeyLZYYMXFZSSDWTH-RFZPGFLSSA-N
MW119.14 g/mol
LogP0.29
Rot. Bonds1

About (2S,3R)-2-fluoro-N-methyloxolan-3-amine

(2S,3R)-2-fluoro-N-methyloxolan-3-amine (PubChem CID 118395136) has the molecular formula C5H10FNO and a molecular weight of 119.14 g/mol. Its IUPAC name is (2S,3R)-2-fluoro-N-methyloxolan-3-amine.

Molecular Properties

Compound Name(2S,3R)-2-fluoro-N-methyloxolan-3-amine
PubChem CID118395136
Molecular FormulaC5H10FNO
Molecular Weight119.14 g/mol
Exact Mass119.07
IUPAC Name(2S,3R)-2-fluoro-N-methyloxolan-3-amine
SMILESCN[C@@H]1CCO[C@H]1F
InChIInChI=1S/C5H10FNO/c1-7-4-2-3-8-5(4)6/h4-5,7H,2-3H2,1H3/t4-,5-/m1/s1
InChIKeyLZYYMXFZSSDWTH-RFZPGFLSSA-N
XLogP0.29
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500119.14
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2S,3R)-2-fluoro-N-methyloxolan-3-amine?
The IUPAC name of (2S,3R)-2-fluoro-N-methyloxolan-3-amine (CID 118395136) is (2S,3R)-2-fluoro-N-methyloxolan-3-amine.
What is the SMILES notation for (2S,3R)-2-fluoro-N-methyloxolan-3-amine?
The canonical SMILES for (2S,3R)-2-fluoro-N-methyloxolan-3-amine is CN[C@@H]1CCO[C@H]1F.
What is the InChIKey of (2S,3R)-2-fluoro-N-methyloxolan-3-amine?
The InChIKey is LZYYMXFZSSDWTH-RFZPGFLSSA-N. The full InChI is InChI=1S/C5H10FNO/c1-7-4-2-3-8-5(4)6/h4-5,7H,2-3H2,1H3/t4-,5-/m1/s1.
What are the key properties of (2S,3R)-2-fluoro-N-methyloxolan-3-amine?
(2S,3R)-2-fluoro-N-methyloxolan-3-amine has a molecular weight of 119.14 g/mol, XLogP of 0.29, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,3R)-2-fluoro-N-methyloxolan-3-amine is sourced from PubChem (CID 118395136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).