[(3R)-3-[[(2R)-2-(4-fluorophenyl)propyl]amino]oxolan-3-yl]methanol

C14H20FNO2 — CID 100649405

IUPAC[(3R)-3-[[(2R)-2-(4-fluorophenyl)propyl]amino]oxolan-3-yl]methanol
SMILESC[C@@H](CN[C@@]1(CO)CCOC1)c1ccc(F)cc1
InChIInChI=1S/C14H20FNO2/c1-11(12-2-4-13(15)5-3-12)8-16-14(9-17)6-7-18-10-14/h2-5,11,16-17H,6-10H2,1H3/t11-,14+/m0/s1
InChIKeyIDLKHXRAEOPYAM-SMDDNHRTSA-N
MW253.32 g/mol
LogP1.67
Rot. Bonds5

About [(3R)-3-[[(2R)-2-(4-fluorophenyl)propyl]amino]oxolan-3-yl]methanol

[(3R)-3-[[(2R)-2-(4-fluorophenyl)propyl]amino]oxolan-3-yl]methanol (PubChem CID 100649405) has the molecular formula C14H20FNO2 and a molecular weight of 253.32 g/mol. Its IUPAC name is [(3R)-3-[[(2R)-2-(4-fluorophenyl)propyl]amino]oxolan-3-yl]methanol.

Molecular Properties

Compound Name[(3R)-3-[[(2R)-2-(4-fluorophenyl)propyl]amino]oxolan-3-yl]methanol
PubChem CID100649405
Molecular FormulaC14H20FNO2
Molecular Weight253.32 g/mol
Exact Mass253.15
IUPAC Name[(3R)-3-[[(2R)-2-(4-fluorophenyl)propyl]amino]oxolan-3-yl]methanol
SMILESC[C@@H](CN[C@@]1(CO)CCOC1)c1ccc(F)cc1
InChIInChI=1S/C14H20FNO2/c1-11(12-2-4-13(15)5-3-12)8-16-14(9-17)6-7-18-10-14/h2-5,11,16-17H,6-10H2,1H3/t11-,14+/m0/s1
InChIKeyIDLKHXRAEOPYAM-SMDDNHRTSA-N
XLogP1.67
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.32
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [(3R)-3-[[(2R)-2-(4-fluorophenyl)propyl]amino]oxolan-3-yl]methanol?
The IUPAC name of [(3R)-3-[[(2R)-2-(4-fluorophenyl)propyl]amino]oxolan-3-yl]methanol (CID 100649405) is [(3R)-3-[[(2R)-2-(4-fluorophenyl)propyl]amino]oxolan-3-yl]methanol.
What is the SMILES notation for [(3R)-3-[[(2R)-2-(4-fluorophenyl)propyl]amino]oxolan-3-yl]methanol?
The canonical SMILES for [(3R)-3-[[(2R)-2-(4-fluorophenyl)propyl]amino]oxolan-3-yl]methanol is C[C@@H](CN[C@@]1(CO)CCOC1)c1ccc(F)cc1.
What is the InChIKey of [(3R)-3-[[(2R)-2-(4-fluorophenyl)propyl]amino]oxolan-3-yl]methanol?
The InChIKey is IDLKHXRAEOPYAM-SMDDNHRTSA-N. The full InChI is InChI=1S/C14H20FNO2/c1-11(12-2-4-13(15)5-3-12)8-16-14(9-17)6-7-18-10-14/h2-5,11,16-17H,6-10H2,1H3/t11-,14+/m0/s1.
What are the key properties of [(3R)-3-[[(2R)-2-(4-fluorophenyl)propyl]amino]oxolan-3-yl]methanol?
[(3R)-3-[[(2R)-2-(4-fluorophenyl)propyl]amino]oxolan-3-yl]methanol has a molecular weight of 253.32 g/mol, XLogP of 1.67, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3R)-3-[[(2R)-2-(4-fluorophenyl)propyl]amino]oxolan-3-yl]methanol is sourced from PubChem (CID 100649405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).