4-[5-fluoro-2-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrimidin-4-yl]morpholine

C16H14FN5OS — CID 25072357

IUPAC4-[5-fluoro-2-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrimidin-4-yl]morpholine
SMILESFc1cnc(-c2nc(-c3ccccn3)cs2)nc1N1CCOCC1
InChIInChI=1S/C16H14FN5OS/c17-11-9-19-14(21-15(11)22-5-7-23-8-6-22)16-20-13(10-24-16)12-3-1-2-4-18-12/h1-4,9-10H,5-8H2
InChIKeyPSCWOGNXEYPEMU-UHFFFAOYSA-N
MW343.39 g/mol
LogP2.64
Rot. Bonds3

About 4-[5-fluoro-2-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrimidin-4-yl]morpholine

4-[5-fluoro-2-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrimidin-4-yl]morpholine (PubChem CID 25072357) has the molecular formula C16H14FN5OS and a molecular weight of 343.39 g/mol. Its IUPAC name is 4-[5-fluoro-2-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrimidin-4-yl]morpholine.

Molecular Properties

Compound Name4-[5-fluoro-2-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrimidin-4-yl]morpholine
PubChem CID25072357
Molecular FormulaC16H14FN5OS
Molecular Weight343.39 g/mol
Exact Mass343.09
IUPAC Name4-[5-fluoro-2-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrimidin-4-yl]morpholine
SMILESFc1cnc(-c2nc(-c3ccccn3)cs2)nc1N1CCOCC1
InChIInChI=1S/C16H14FN5OS/c17-11-9-19-14(21-15(11)22-5-7-23-8-6-22)16-20-13(10-24-16)12-3-1-2-4-18-12/h1-4,9-10H,5-8H2
InChIKeyPSCWOGNXEYPEMU-UHFFFAOYSA-N
XLogP2.64
TPSA64.03 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.39
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-[5-fluoro-2-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrimidin-4-yl]morpholine?
The IUPAC name of 4-[5-fluoro-2-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrimidin-4-yl]morpholine (CID 25072357) is 4-[5-fluoro-2-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrimidin-4-yl]morpholine.
What is the SMILES notation for 4-[5-fluoro-2-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrimidin-4-yl]morpholine?
The canonical SMILES for 4-[5-fluoro-2-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrimidin-4-yl]morpholine is Fc1cnc(-c2nc(-c3ccccn3)cs2)nc1N1CCOCC1.
What is the InChIKey of 4-[5-fluoro-2-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrimidin-4-yl]morpholine?
The InChIKey is PSCWOGNXEYPEMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FN5OS/c17-11-9-19-14(21-15(11)22-5-7-23-8-6-22)16-20-13(10-24-16)12-3-1-2-4-18-12/h1-4,9-10H,5-8H2.
What are the key properties of 4-[5-fluoro-2-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrimidin-4-yl]morpholine?
4-[5-fluoro-2-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrimidin-4-yl]morpholine has a molecular weight of 343.39 g/mol, XLogP of 2.64, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-fluoro-2-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrimidin-4-yl]morpholine is sourced from PubChem (CID 25072357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).