4-(4-piperidin-1-yl-1,3,5-triazin-2-yl)morpholine

C12H19N5O — CID 69000556

IUPAC4-(4-piperidin-1-yl-1,3,5-triazin-2-yl)morpholine
SMILESc1nc(N2CCCCC2)nc(N2CCOCC2)n1
InChIInChI=1S/C12H19N5O/c1-2-4-16(5-3-1)11-13-10-14-12(15-11)17-6-8-18-9-7-17/h10H,1-9H2
InChIKeyJZRBBCBHZOUVFC-UHFFFAOYSA-N
MW249.32 g/mol
LogP0.70
Rot. Bonds2

About 4-(4-piperidin-1-yl-1,3,5-triazin-2-yl)morpholine

4-(4-piperidin-1-yl-1,3,5-triazin-2-yl)morpholine (PubChem CID 69000556) has the molecular formula C12H19N5O and a molecular weight of 249.32 g/mol. Its IUPAC name is 4-(4-piperidin-1-yl-1,3,5-triazin-2-yl)morpholine.

Molecular Properties

Compound Name4-(4-piperidin-1-yl-1,3,5-triazin-2-yl)morpholine
PubChem CID69000556
Molecular FormulaC12H19N5O
Molecular Weight249.32 g/mol
Exact Mass249.16
IUPAC Name4-(4-piperidin-1-yl-1,3,5-triazin-2-yl)morpholine
SMILESc1nc(N2CCCCC2)nc(N2CCOCC2)n1
InChIInChI=1S/C12H19N5O/c1-2-4-16(5-3-1)11-13-10-14-12(15-11)17-6-8-18-9-7-17/h10H,1-9H2
InChIKeyJZRBBCBHZOUVFC-UHFFFAOYSA-N
XLogP0.70
TPSA54.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.32
LogP ≤ 50.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(4-piperidin-1-yl-1,3,5-triazin-2-yl)morpholine?
The IUPAC name of 4-(4-piperidin-1-yl-1,3,5-triazin-2-yl)morpholine (CID 69000556) is 4-(4-piperidin-1-yl-1,3,5-triazin-2-yl)morpholine.
What is the SMILES notation for 4-(4-piperidin-1-yl-1,3,5-triazin-2-yl)morpholine?
The canonical SMILES for 4-(4-piperidin-1-yl-1,3,5-triazin-2-yl)morpholine is c1nc(N2CCCCC2)nc(N2CCOCC2)n1.
What is the InChIKey of 4-(4-piperidin-1-yl-1,3,5-triazin-2-yl)morpholine?
The InChIKey is JZRBBCBHZOUVFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5O/c1-2-4-16(5-3-1)11-13-10-14-12(15-11)17-6-8-18-9-7-17/h10H,1-9H2.
What are the key properties of 4-(4-piperidin-1-yl-1,3,5-triazin-2-yl)morpholine?
4-(4-piperidin-1-yl-1,3,5-triazin-2-yl)morpholine has a molecular weight of 249.32 g/mol, XLogP of 0.70, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-piperidin-1-yl-1,3,5-triazin-2-yl)morpholine is sourced from PubChem (CID 69000556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).