(2S)-2-[(S)-(2,6-difluorophenoxy)-pyridin-2-ylmethyl]morpholine

C16H16F2N2O2 — CID 44578972

IUPAC(2S)-2-[(S)-(2,6-difluorophenoxy)-pyridin-2-ylmethyl]morpholine
SMILESFc1cccc(F)c1O[C@@H](c1ccccn1)[C@@H]1CNCCO1
InChIInChI=1S/C16H16F2N2O2/c17-11-4-3-5-12(18)15(11)22-16(13-6-1-2-7-20-13)14-10-19-8-9-21-14/h1-7,14,16,19H,8-10H2/t14-,16-/m0/s1
InChIKeyQIVITPMRYRPJPE-HOCLYGCPSA-N
MW306.31 g/mol
LogP2.47
Rot. Bonds4

About (2S)-2-[(S)-(2,6-difluorophenoxy)-pyridin-2-ylmethyl]morpholine

(2S)-2-[(S)-(2,6-difluorophenoxy)-pyridin-2-ylmethyl]morpholine (PubChem CID 44578972) has the molecular formula C16H16F2N2O2 and a molecular weight of 306.31 g/mol. Its IUPAC name is (2S)-2-[(S)-(2,6-difluorophenoxy)-pyridin-2-ylmethyl]morpholine.

Molecular Properties

Compound Name(2S)-2-[(S)-(2,6-difluorophenoxy)-pyridin-2-ylmethyl]morpholine
PubChem CID44578972
Molecular FormulaC16H16F2N2O2
Molecular Weight306.31 g/mol
Exact Mass306.12
IUPAC Name(2S)-2-[(S)-(2,6-difluorophenoxy)-pyridin-2-ylmethyl]morpholine
SMILESFc1cccc(F)c1O[C@@H](c1ccccn1)[C@@H]1CNCCO1
InChIInChI=1S/C16H16F2N2O2/c17-11-4-3-5-12(18)15(11)22-16(13-6-1-2-7-20-13)14-10-19-8-9-21-14/h1-7,14,16,19H,8-10H2/t14-,16-/m0/s1
InChIKeyQIVITPMRYRPJPE-HOCLYGCPSA-N
XLogP2.47
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.31
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2S)-2-[(S)-(2,6-difluorophenoxy)-pyridin-2-ylmethyl]morpholine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2S)-2-[(S)-(2,6-difluorophenoxy)-pyridin-2-ylmethyl]morpholine?
The IUPAC name of (2S)-2-[(S)-(2,6-difluorophenoxy)-pyridin-2-ylmethyl]morpholine (CID 44578972) is (2S)-2-[(S)-(2,6-difluorophenoxy)-pyridin-2-ylmethyl]morpholine.
What is the SMILES notation for (2S)-2-[(S)-(2,6-difluorophenoxy)-pyridin-2-ylmethyl]morpholine?
The canonical SMILES for (2S)-2-[(S)-(2,6-difluorophenoxy)-pyridin-2-ylmethyl]morpholine is Fc1cccc(F)c1O[C@@H](c1ccccn1)[C@@H]1CNCCO1.
What is the InChIKey of (2S)-2-[(S)-(2,6-difluorophenoxy)-pyridin-2-ylmethyl]morpholine?
The InChIKey is QIVITPMRYRPJPE-HOCLYGCPSA-N. The full InChI is InChI=1S/C16H16F2N2O2/c17-11-4-3-5-12(18)15(11)22-16(13-6-1-2-7-20-13)14-10-19-8-9-21-14/h1-7,14,16,19H,8-10H2/t14-,16-/m0/s1.
What are the key properties of (2S)-2-[(S)-(2,6-difluorophenoxy)-pyridin-2-ylmethyl]morpholine?
(2S)-2-[(S)-(2,6-difluorophenoxy)-pyridin-2-ylmethyl]morpholine has a molecular weight of 306.31 g/mol, XLogP of 2.47, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-[(S)-(2,6-difluorophenoxy)-pyridin-2-ylmethyl]morpholine is sourced from PubChem (CID 44578972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).