4-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)morpholine

C12H19N3O2 — CID 721081

IUPAC4-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)morpholine
SMILESCc1cc(OC(C)C)nc(N2CCOCC2)n1
InChIInChI=1S/C12H19N3O2/c1-9(2)17-11-8-10(3)13-12(14-11)15-4-6-16-7-5-15/h8-9H,4-7H2,1-3H3
InChIKeyKNSCUZQBOPEQKI-UHFFFAOYSA-N
MW237.30 g/mol
LogP1.41
Rot. Bonds3

About 4-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)morpholine

4-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)morpholine (PubChem CID 721081) has the molecular formula C12H19N3O2 and a molecular weight of 237.30 g/mol. Its IUPAC name is 4-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)morpholine.

Molecular Properties

Compound Name4-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)morpholine
PubChem CID721081
Molecular FormulaC12H19N3O2
Molecular Weight237.30 g/mol
Exact Mass237.15
IUPAC Name4-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)morpholine
SMILESCc1cc(OC(C)C)nc(N2CCOCC2)n1
InChIInChI=1S/C12H19N3O2/c1-9(2)17-11-8-10(3)13-12(14-11)15-4-6-16-7-5-15/h8-9H,4-7H2,1-3H3
InChIKeyKNSCUZQBOPEQKI-UHFFFAOYSA-N
XLogP1.41
TPSA47.48 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 51.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)morpholine?
The IUPAC name of 4-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)morpholine (CID 721081) is 4-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)morpholine.
What is the SMILES notation for 4-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)morpholine?
The canonical SMILES for 4-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)morpholine is Cc1cc(OC(C)C)nc(N2CCOCC2)n1.
What is the InChIKey of 4-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)morpholine?
The InChIKey is KNSCUZQBOPEQKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2/c1-9(2)17-11-8-10(3)13-12(14-11)15-4-6-16-7-5-15/h8-9H,4-7H2,1-3H3.
What are the key properties of 4-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)morpholine?
4-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)morpholine has a molecular weight of 237.30 g/mol, XLogP of 1.41, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)morpholine is sourced from PubChem (CID 721081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).