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

C14H23N5O — CID 72867087

IUPAC4-[2-(4-pyrimidin-4-ylpiperazin-1-yl)ethyl]morpholine
SMILESc1cc(N2CCN(CCN3CCOCC3)CC2)ncn1
InChIInChI=1S/C14H23N5O/c1-2-15-13-16-14(1)19-7-5-17(6-8-19)3-4-18-9-11-20-12-10-18/h1-2,13H,3-12H2
InChIKeyFJBDBFOAMPJJNH-UHFFFAOYSA-N
MW277.37 g/mol
LogP-0.07
Rot. Bonds4

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

4-[2-(4-pyrimidin-4-ylpiperazin-1-yl)ethyl]morpholine (PubChem CID 72867087) has the molecular formula C14H23N5O and a molecular weight of 277.37 g/mol. Its IUPAC name is 4-[2-(4-pyrimidin-4-ylpiperazin-1-yl)ethyl]morpholine.

Molecular Properties

Compound Name4-[2-(4-pyrimidin-4-ylpiperazin-1-yl)ethyl]morpholine
PubChem CID72867087
Molecular FormulaC14H23N5O
Molecular Weight277.37 g/mol
Exact Mass277.19
IUPAC Name4-[2-(4-pyrimidin-4-ylpiperazin-1-yl)ethyl]morpholine
SMILESc1cc(N2CCN(CCN3CCOCC3)CC2)ncn1
InChIInChI=1S/C14H23N5O/c1-2-15-13-16-14(1)19-7-5-17(6-8-19)3-4-18-9-11-20-12-10-18/h1-2,13H,3-12H2
InChIKeyFJBDBFOAMPJJNH-UHFFFAOYSA-N
XLogP-0.07
TPSA44.73 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 5-0.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-pyrimidin-4-ylpiperazin-1-yl)ethyl]morpholine?
The IUPAC name of 4-[2-(4-pyrimidin-4-ylpiperazin-1-yl)ethyl]morpholine (CID 72867087) is 4-[2-(4-pyrimidin-4-ylpiperazin-1-yl)ethyl]morpholine.
What is the SMILES notation for 4-[2-(4-pyrimidin-4-ylpiperazin-1-yl)ethyl]morpholine?
The canonical SMILES for 4-[2-(4-pyrimidin-4-ylpiperazin-1-yl)ethyl]morpholine is c1cc(N2CCN(CCN3CCOCC3)CC2)ncn1.
What is the InChIKey of 4-[2-(4-pyrimidin-4-ylpiperazin-1-yl)ethyl]morpholine?
The InChIKey is FJBDBFOAMPJJNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O/c1-2-15-13-16-14(1)19-7-5-17(6-8-19)3-4-18-9-11-20-12-10-18/h1-2,13H,3-12H2.
What are the key properties of 4-[2-(4-pyrimidin-4-ylpiperazin-1-yl)ethyl]morpholine?
4-[2-(4-pyrimidin-4-ylpiperazin-1-yl)ethyl]morpholine has a molecular weight of 277.37 g/mol, XLogP of -0.07, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-pyrimidin-4-ylpiperazin-1-yl)ethyl]morpholine is sourced from PubChem (CID 72867087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).