5-fluoro-N-[(2S,3R)-2-phenyloxolan-3-yl]pyridin-2-amine

C15H15FN2O — CID 124734601

IUPAC5-fluoro-N-[(2S,3R)-2-phenyloxolan-3-yl]pyridin-2-amine
SMILESFc1ccc(N[C@@H]2CCO[C@H]2c2ccccc2)nc1
InChIInChI=1S/C15H15FN2O/c16-12-6-7-14(17-10-12)18-13-8-9-19-15(13)11-4-2-1-3-5-11/h1-7,10,13,15H,8-9H2,(H,17,18)/t13-,15+/m1/s1
InChIKeyMNAIUYCRUQJMQQ-HIFRSBDPSA-N
MW258.30 g/mol
LogP3.16
Rot. Bonds3

About 5-fluoro-N-[(2S,3R)-2-phenyloxolan-3-yl]pyridin-2-amine

5-fluoro-N-[(2S,3R)-2-phenyloxolan-3-yl]pyridin-2-amine (PubChem CID 124734601) has the molecular formula C15H15FN2O and a molecular weight of 258.30 g/mol. Its IUPAC name is 5-fluoro-N-[(2S,3R)-2-phenyloxolan-3-yl]pyridin-2-amine.

Molecular Properties

Compound Name5-fluoro-N-[(2S,3R)-2-phenyloxolan-3-yl]pyridin-2-amine
PubChem CID124734601
Molecular FormulaC15H15FN2O
Molecular Weight258.30 g/mol
Exact Mass258.12
IUPAC Name5-fluoro-N-[(2S,3R)-2-phenyloxolan-3-yl]pyridin-2-amine
SMILESFc1ccc(N[C@@H]2CCO[C@H]2c2ccccc2)nc1
InChIInChI=1S/C15H15FN2O/c16-12-6-7-14(17-10-12)18-13-8-9-19-15(13)11-4-2-1-3-5-11/h1-7,10,13,15H,8-9H2,(H,17,18)/t13-,15+/m1/s1
InChIKeyMNAIUYCRUQJMQQ-HIFRSBDPSA-N
XLogP3.16
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.30
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N-[(2S,3R)-2-phenyloxolan-3-yl]pyridin-2-amine?
The IUPAC name of 5-fluoro-N-[(2S,3R)-2-phenyloxolan-3-yl]pyridin-2-amine (CID 124734601) is 5-fluoro-N-[(2S,3R)-2-phenyloxolan-3-yl]pyridin-2-amine.
What is the SMILES notation for 5-fluoro-N-[(2S,3R)-2-phenyloxolan-3-yl]pyridin-2-amine?
The canonical SMILES for 5-fluoro-N-[(2S,3R)-2-phenyloxolan-3-yl]pyridin-2-amine is Fc1ccc(N[C@@H]2CCO[C@H]2c2ccccc2)nc1.
What is the InChIKey of 5-fluoro-N-[(2S,3R)-2-phenyloxolan-3-yl]pyridin-2-amine?
The InChIKey is MNAIUYCRUQJMQQ-HIFRSBDPSA-N. The full InChI is InChI=1S/C15H15FN2O/c16-12-6-7-14(17-10-12)18-13-8-9-19-15(13)11-4-2-1-3-5-11/h1-7,10,13,15H,8-9H2,(H,17,18)/t13-,15+/m1/s1.
What are the key properties of 5-fluoro-N-[(2S,3R)-2-phenyloxolan-3-yl]pyridin-2-amine?
5-fluoro-N-[(2S,3R)-2-phenyloxolan-3-yl]pyridin-2-amine has a molecular weight of 258.30 g/mol, XLogP of 3.16, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N-[(2S,3R)-2-phenyloxolan-3-yl]pyridin-2-amine is sourced from PubChem (CID 124734601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).