4-(4,6-dimethylpyrimidin-2-yl)-2-methyl-2-(1-methylpyrazol-4-yl)morpholine

C15H21N5O — CID 133364977

IUPAC4-(4,6-dimethylpyrimidin-2-yl)-2-methyl-2-(1-methylpyrazol-4-yl)morpholine
SMILESCc1cc(C)nc(N2CCOC(C)(c3cnn(C)c3)C2)n1
InChIInChI=1S/C15H21N5O/c1-11-7-12(2)18-14(17-11)20-5-6-21-15(3,10-20)13-8-16-19(4)9-13/h7-9H,5-6,10H2,1-4H3
InChIKeyFXGYZSXSHGOJJK-UHFFFAOYSA-N
MW287.37 g/mol
LogP1.58
Rot. Bonds2

About 4-(4,6-dimethylpyrimidin-2-yl)-2-methyl-2-(1-methylpyrazol-4-yl)morpholine

4-(4,6-dimethylpyrimidin-2-yl)-2-methyl-2-(1-methylpyrazol-4-yl)morpholine (PubChem CID 133364977) has the molecular formula C15H21N5O and a molecular weight of 287.37 g/mol. Its IUPAC name is 4-(4,6-dimethylpyrimidin-2-yl)-2-methyl-2-(1-methylpyrazol-4-yl)morpholine.

Molecular Properties

Compound Name4-(4,6-dimethylpyrimidin-2-yl)-2-methyl-2-(1-methylpyrazol-4-yl)morpholine
PubChem CID133364977
Molecular FormulaC15H21N5O
Molecular Weight287.37 g/mol
Exact Mass287.17
IUPAC Name4-(4,6-dimethylpyrimidin-2-yl)-2-methyl-2-(1-methylpyrazol-4-yl)morpholine
SMILESCc1cc(C)nc(N2CCOC(C)(c3cnn(C)c3)C2)n1
InChIInChI=1S/C15H21N5O/c1-11-7-12(2)18-14(17-11)20-5-6-21-15(3,10-20)13-8-16-19(4)9-13/h7-9H,5-6,10H2,1-4H3
InChIKeyFXGYZSXSHGOJJK-UHFFFAOYSA-N
XLogP1.58
TPSA56.07 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.37
LogP ≤ 51.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(4,6-dimethylpyrimidin-2-yl)-2-methyl-2-(1-methylpyrazol-4-yl)morpholine?
The IUPAC name of 4-(4,6-dimethylpyrimidin-2-yl)-2-methyl-2-(1-methylpyrazol-4-yl)morpholine (CID 133364977) is 4-(4,6-dimethylpyrimidin-2-yl)-2-methyl-2-(1-methylpyrazol-4-yl)morpholine.
What is the SMILES notation for 4-(4,6-dimethylpyrimidin-2-yl)-2-methyl-2-(1-methylpyrazol-4-yl)morpholine?
The canonical SMILES for 4-(4,6-dimethylpyrimidin-2-yl)-2-methyl-2-(1-methylpyrazol-4-yl)morpholine is Cc1cc(C)nc(N2CCOC(C)(c3cnn(C)c3)C2)n1.
What is the InChIKey of 4-(4,6-dimethylpyrimidin-2-yl)-2-methyl-2-(1-methylpyrazol-4-yl)morpholine?
The InChIKey is FXGYZSXSHGOJJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O/c1-11-7-12(2)18-14(17-11)20-5-6-21-15(3,10-20)13-8-16-19(4)9-13/h7-9H,5-6,10H2,1-4H3.
What are the key properties of 4-(4,6-dimethylpyrimidin-2-yl)-2-methyl-2-(1-methylpyrazol-4-yl)morpholine?
4-(4,6-dimethylpyrimidin-2-yl)-2-methyl-2-(1-methylpyrazol-4-yl)morpholine has a molecular weight of 287.37 g/mol, XLogP of 1.58, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4,6-dimethylpyrimidin-2-yl)-2-methyl-2-(1-methylpyrazol-4-yl)morpholine is sourced from PubChem (CID 133364977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).