[(2S)-2-fluoro-3-hydroxy-2-methylpropyl] carbamate

C5H10FNO3 — CID 175247654

IUPAC[(2S)-2-fluoro-3-hydroxy-2-methylpropyl] carbamate
SMILESC[C@](F)(CO)COC(N)=O
InChIInChI=1S/C5H10FNO3/c1-5(6,2-8)3-10-4(7)9/h8H,2-3H2,1H3,(H2,7,9)/t5-/m0/s1
InChIKeyGXMSJBOXKZOWKG-YFKPBYRVSA-N
MW151.14 g/mol
LogP-0.20
Rot. Bonds3

About [(2S)-2-fluoro-3-hydroxy-2-methylpropyl] carbamate

[(2S)-2-fluoro-3-hydroxy-2-methylpropyl] carbamate (PubChem CID 175247654) has the molecular formula C5H10FNO3 and a molecular weight of 151.14 g/mol. Its IUPAC name is [(2S)-2-fluoro-3-hydroxy-2-methylpropyl] carbamate.

Molecular Properties

Compound Name[(2S)-2-fluoro-3-hydroxy-2-methylpropyl] carbamate
PubChem CID175247654
Molecular FormulaC5H10FNO3
Molecular Weight151.14 g/mol
Exact Mass151.06
IUPAC Name[(2S)-2-fluoro-3-hydroxy-2-methylpropyl] carbamate
SMILESC[C@](F)(CO)COC(N)=O
InChIInChI=1S/C5H10FNO3/c1-5(6,2-8)3-10-4(7)9/h8H,2-3H2,1H3,(H2,7,9)/t5-/m0/s1
InChIKeyGXMSJBOXKZOWKG-YFKPBYRVSA-N
XLogP-0.20
TPSA72.55 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.14
LogP ≤ 5-0.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [(2S)-2-fluoro-3-hydroxy-2-methylpropyl] carbamate?
The IUPAC name of [(2S)-2-fluoro-3-hydroxy-2-methylpropyl] carbamate (CID 175247654) is [(2S)-2-fluoro-3-hydroxy-2-methylpropyl] carbamate.
What is the SMILES notation for [(2S)-2-fluoro-3-hydroxy-2-methylpropyl] carbamate?
The canonical SMILES for [(2S)-2-fluoro-3-hydroxy-2-methylpropyl] carbamate is C[C@](F)(CO)COC(N)=O.
What is the InChIKey of [(2S)-2-fluoro-3-hydroxy-2-methylpropyl] carbamate?
The InChIKey is GXMSJBOXKZOWKG-YFKPBYRVSA-N. The full InChI is InChI=1S/C5H10FNO3/c1-5(6,2-8)3-10-4(7)9/h8H,2-3H2,1H3,(H2,7,9)/t5-/m0/s1.
What are the key properties of [(2S)-2-fluoro-3-hydroxy-2-methylpropyl] carbamate?
[(2S)-2-fluoro-3-hydroxy-2-methylpropyl] carbamate has a molecular weight of 151.14 g/mol, XLogP of -0.20, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S)-2-fluoro-3-hydroxy-2-methylpropyl] carbamate is sourced from PubChem (CID 175247654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).