4-[5-[5-(3-methyl-1,2-oxazol-5-yl)pyrimidin-4-yl]-2-pyridinyl]morpholine

C17H17N5O2 — CID 46981766

IUPAC4-[5-[5-(3-methyl-1,2-oxazol-5-yl)pyrimidin-4-yl]-2-pyridinyl]morpholine
SMILESCc1cc(-c2cncnc2-c2ccc(N3CCOCC3)nc2)on1
InChIInChI=1S/C17H17N5O2/c1-12-8-15(24-21-12)14-10-18-11-20-17(14)13-2-3-16(19-9-13)22-4-6-23-7-5-22/h2-3,8-11H,4-7H2,1H3
InChIKeyMEZGISHKSOOSQY-UHFFFAOYSA-N
MW323.36 g/mol
LogP2.34
Rot. Bonds3

About 4-[5-[5-(3-methyl-1,2-oxazol-5-yl)pyrimidin-4-yl]-2-pyridinyl]morpholine

4-[5-[5-(3-methyl-1,2-oxazol-5-yl)pyrimidin-4-yl]-2-pyridinyl]morpholine (PubChem CID 46981766) has the molecular formula C17H17N5O2 and a molecular weight of 323.36 g/mol. Its IUPAC name is 4-[5-[5-(3-methyl-1,2-oxazol-5-yl)pyrimidin-4-yl]-2-pyridinyl]morpholine.

Molecular Properties

Compound Name4-[5-[5-(3-methyl-1,2-oxazol-5-yl)pyrimidin-4-yl]-2-pyridinyl]morpholine
PubChem CID46981766
Molecular FormulaC17H17N5O2
Molecular Weight323.36 g/mol
Exact Mass323.14
IUPAC Name4-[5-[5-(3-methyl-1,2-oxazol-5-yl)pyrimidin-4-yl]-2-pyridinyl]morpholine
SMILESCc1cc(-c2cncnc2-c2ccc(N3CCOCC3)nc2)on1
InChIInChI=1S/C17H17N5O2/c1-12-8-15(24-21-12)14-10-18-11-20-17(14)13-2-3-16(19-9-13)22-4-6-23-7-5-22/h2-3,8-11H,4-7H2,1H3
InChIKeyMEZGISHKSOOSQY-UHFFFAOYSA-N
XLogP2.34
TPSA77.17 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.36
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-[5-[5-(3-methyl-1,2-oxazol-5-yl)pyrimidin-4-yl]-2-pyridinyl]morpholine?
The IUPAC name of 4-[5-[5-(3-methyl-1,2-oxazol-5-yl)pyrimidin-4-yl]-2-pyridinyl]morpholine (CID 46981766) is 4-[5-[5-(3-methyl-1,2-oxazol-5-yl)pyrimidin-4-yl]-2-pyridinyl]morpholine.
What is the SMILES notation for 4-[5-[5-(3-methyl-1,2-oxazol-5-yl)pyrimidin-4-yl]-2-pyridinyl]morpholine?
The canonical SMILES for 4-[5-[5-(3-methyl-1,2-oxazol-5-yl)pyrimidin-4-yl]-2-pyridinyl]morpholine is Cc1cc(-c2cncnc2-c2ccc(N3CCOCC3)nc2)on1.
What is the InChIKey of 4-[5-[5-(3-methyl-1,2-oxazol-5-yl)pyrimidin-4-yl]-2-pyridinyl]morpholine?
The InChIKey is MEZGISHKSOOSQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N5O2/c1-12-8-15(24-21-12)14-10-18-11-20-17(14)13-2-3-16(19-9-13)22-4-6-23-7-5-22/h2-3,8-11H,4-7H2,1H3.
What are the key properties of 4-[5-[5-(3-methyl-1,2-oxazol-5-yl)pyrimidin-4-yl]-2-pyridinyl]morpholine?
4-[5-[5-(3-methyl-1,2-oxazol-5-yl)pyrimidin-4-yl]-2-pyridinyl]morpholine has a molecular weight of 323.36 g/mol, XLogP of 2.34, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-[5-(3-methyl-1,2-oxazol-5-yl)pyrimidin-4-yl]-2-pyridinyl]morpholine is sourced from PubChem (CID 46981766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).