4-[2-[5-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-1,2-oxazol-3-yl]ethyl]morpholine

C19H26N4O3 — CID 71457186

IUPAC4-[2-[5-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-1,2-oxazol-3-yl]ethyl]morpholine
SMILESc1ncc(-c2cc(CCN3CCOCC3)no2)cc1OC[C@@H]1CCCN1
InChIInChI=1S/C19H26N4O3/c1-2-17(21-4-1)14-25-18-10-15(12-20-13-18)19-11-16(22-26-19)3-5-23-6-8-24-9-7-23/h10-13,17,21H,1-9,14H2/t17-/m0/s1
InChIKeyOLOFNTFJYWPNBX-KRWDZBQOSA-N
MW358.44 g/mol
LogP1.74
Rot. Bonds7

About 4-[2-[5-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-1,2-oxazol-3-yl]ethyl]morpholine

4-[2-[5-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-1,2-oxazol-3-yl]ethyl]morpholine (PubChem CID 71457186) has the molecular formula C19H26N4O3 and a molecular weight of 358.44 g/mol. Its IUPAC name is 4-[2-[5-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-1,2-oxazol-3-yl]ethyl]morpholine.

Molecular Properties

Compound Name4-[2-[5-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-1,2-oxazol-3-yl]ethyl]morpholine
PubChem CID71457186
Molecular FormulaC19H26N4O3
Molecular Weight358.44 g/mol
Exact Mass358.20
IUPAC Name4-[2-[5-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-1,2-oxazol-3-yl]ethyl]morpholine
SMILESc1ncc(-c2cc(CCN3CCOCC3)no2)cc1OC[C@@H]1CCCN1
InChIInChI=1S/C19H26N4O3/c1-2-17(21-4-1)14-25-18-10-15(12-20-13-18)19-11-16(22-26-19)3-5-23-6-8-24-9-7-23/h10-13,17,21H,1-9,14H2/t17-/m0/s1
InChIKeyOLOFNTFJYWPNBX-KRWDZBQOSA-N
XLogP1.74
TPSA72.65 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.44
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-[2-[5-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-1,2-oxazol-3-yl]ethyl]morpholine?
The IUPAC name of 4-[2-[5-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-1,2-oxazol-3-yl]ethyl]morpholine (CID 71457186) is 4-[2-[5-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-1,2-oxazol-3-yl]ethyl]morpholine.
What is the SMILES notation for 4-[2-[5-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-1,2-oxazol-3-yl]ethyl]morpholine?
The canonical SMILES for 4-[2-[5-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-1,2-oxazol-3-yl]ethyl]morpholine is c1ncc(-c2cc(CCN3CCOCC3)no2)cc1OC[C@@H]1CCCN1.
What is the InChIKey of 4-[2-[5-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-1,2-oxazol-3-yl]ethyl]morpholine?
The InChIKey is OLOFNTFJYWPNBX-KRWDZBQOSA-N. The full InChI is InChI=1S/C19H26N4O3/c1-2-17(21-4-1)14-25-18-10-15(12-20-13-18)19-11-16(22-26-19)3-5-23-6-8-24-9-7-23/h10-13,17,21H,1-9,14H2/t17-/m0/s1.
What are the key properties of 4-[2-[5-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-1,2-oxazol-3-yl]ethyl]morpholine?
4-[2-[5-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-1,2-oxazol-3-yl]ethyl]morpholine has a molecular weight of 358.44 g/mol, XLogP of 1.74, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[5-[5-[[(2S)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]-1,2-oxazol-3-yl]ethyl]morpholine is sourced from PubChem (CID 71457186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).