4-[4-ethyl-6-(1-methylpyrazol-4-yl)pyrimidin-2-yl]morpholine

C14H19N5O — CID 39756782

IUPAC4-[4-ethyl-6-(1-methylpyrazol-4-yl)pyrimidin-2-yl]morpholine
SMILESCCc1cc(-c2cnn(C)c2)nc(N2CCOCC2)n1
InChIInChI=1S/C14H19N5O/c1-3-12-8-13(11-9-15-18(2)10-11)17-14(16-12)19-4-6-20-7-5-19/h8-10H,3-7H2,1-2H3
InChIKeySDWIDGMGSUQALV-UHFFFAOYSA-N
MW273.34 g/mol
LogP1.28
Rot. Bonds3

About 4-[4-ethyl-6-(1-methylpyrazol-4-yl)pyrimidin-2-yl]morpholine

4-[4-ethyl-6-(1-methylpyrazol-4-yl)pyrimidin-2-yl]morpholine (PubChem CID 39756782) has the molecular formula C14H19N5O and a molecular weight of 273.34 g/mol. Its IUPAC name is 4-[4-ethyl-6-(1-methylpyrazol-4-yl)pyrimidin-2-yl]morpholine.

Molecular Properties

Compound Name4-[4-ethyl-6-(1-methylpyrazol-4-yl)pyrimidin-2-yl]morpholine
PubChem CID39756782
Molecular FormulaC14H19N5O
Molecular Weight273.34 g/mol
Exact Mass273.16
IUPAC Name4-[4-ethyl-6-(1-methylpyrazol-4-yl)pyrimidin-2-yl]morpholine
SMILESCCc1cc(-c2cnn(C)c2)nc(N2CCOCC2)n1
InChIInChI=1S/C14H19N5O/c1-3-12-8-13(11-9-15-18(2)10-11)17-14(16-12)19-4-6-20-7-5-19/h8-10H,3-7H2,1-2H3
InChIKeySDWIDGMGSUQALV-UHFFFAOYSA-N
XLogP1.28
TPSA56.07 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-[4-ethyl-6-(1-methylpyrazol-4-yl)pyrimidin-2-yl]morpholine?
The IUPAC name of 4-[4-ethyl-6-(1-methylpyrazol-4-yl)pyrimidin-2-yl]morpholine (CID 39756782) is 4-[4-ethyl-6-(1-methylpyrazol-4-yl)pyrimidin-2-yl]morpholine.
What is the SMILES notation for 4-[4-ethyl-6-(1-methylpyrazol-4-yl)pyrimidin-2-yl]morpholine?
The canonical SMILES for 4-[4-ethyl-6-(1-methylpyrazol-4-yl)pyrimidin-2-yl]morpholine is CCc1cc(-c2cnn(C)c2)nc(N2CCOCC2)n1.
What is the InChIKey of 4-[4-ethyl-6-(1-methylpyrazol-4-yl)pyrimidin-2-yl]morpholine?
The InChIKey is SDWIDGMGSUQALV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5O/c1-3-12-8-13(11-9-15-18(2)10-11)17-14(16-12)19-4-6-20-7-5-19/h8-10H,3-7H2,1-2H3.
What are the key properties of 4-[4-ethyl-6-(1-methylpyrazol-4-yl)pyrimidin-2-yl]morpholine?
4-[4-ethyl-6-(1-methylpyrazol-4-yl)pyrimidin-2-yl]morpholine has a molecular weight of 273.34 g/mol, XLogP of 1.28, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-ethyl-6-(1-methylpyrazol-4-yl)pyrimidin-2-yl]morpholine is sourced from PubChem (CID 39756782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).