2-cyclopropyl-6-methyl-4-(6-methylpyrimidin-4-yl)morpholine

C13H19N3O — CID 154779371

IUPAC2-cyclopropyl-6-methyl-4-(6-methylpyrimidin-4-yl)morpholine
SMILESCc1cc(N2CC(C)OC(C3CC3)C2)ncn1
InChIInChI=1S/C13H19N3O/c1-9-5-13(15-8-14-9)16-6-10(2)17-12(7-16)11-3-4-11/h5,8,10-12H,3-4,6-7H2,1-2H3
InChIKeyNXRDCBZJQIADPG-UHFFFAOYSA-N
MW233.31 g/mol
LogP1.79
Rot. Bonds2

About 2-cyclopropyl-6-methyl-4-(6-methylpyrimidin-4-yl)morpholine

2-cyclopropyl-6-methyl-4-(6-methylpyrimidin-4-yl)morpholine (PubChem CID 154779371) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is 2-cyclopropyl-6-methyl-4-(6-methylpyrimidin-4-yl)morpholine.

Molecular Properties

Compound Name2-cyclopropyl-6-methyl-4-(6-methylpyrimidin-4-yl)morpholine
PubChem CID154779371
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC Name2-cyclopropyl-6-methyl-4-(6-methylpyrimidin-4-yl)morpholine
SMILESCc1cc(N2CC(C)OC(C3CC3)C2)ncn1
InChIInChI=1S/C13H19N3O/c1-9-5-13(15-8-14-9)16-6-10(2)17-12(7-16)11-3-4-11/h5,8,10-12H,3-4,6-7H2,1-2H3
InChIKeyNXRDCBZJQIADPG-UHFFFAOYSA-N
XLogP1.79
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 51.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-6-methyl-4-(6-methylpyrimidin-4-yl)morpholine?
The IUPAC name of 2-cyclopropyl-6-methyl-4-(6-methylpyrimidin-4-yl)morpholine (CID 154779371) is 2-cyclopropyl-6-methyl-4-(6-methylpyrimidin-4-yl)morpholine.
What is the SMILES notation for 2-cyclopropyl-6-methyl-4-(6-methylpyrimidin-4-yl)morpholine?
The canonical SMILES for 2-cyclopropyl-6-methyl-4-(6-methylpyrimidin-4-yl)morpholine is Cc1cc(N2CC(C)OC(C3CC3)C2)ncn1.
What is the InChIKey of 2-cyclopropyl-6-methyl-4-(6-methylpyrimidin-4-yl)morpholine?
The InChIKey is NXRDCBZJQIADPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-9-5-13(15-8-14-9)16-6-10(2)17-12(7-16)11-3-4-11/h5,8,10-12H,3-4,6-7H2,1-2H3.
What are the key properties of 2-cyclopropyl-6-methyl-4-(6-methylpyrimidin-4-yl)morpholine?
2-cyclopropyl-6-methyl-4-(6-methylpyrimidin-4-yl)morpholine has a molecular weight of 233.31 g/mol, XLogP of 1.79, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-6-methyl-4-(6-methylpyrimidin-4-yl)morpholine is sourced from PubChem (CID 154779371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).