4-[6-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]pyrimidin-4-yl]morpholine

C19H26N6O — CID 171326602

IUPAC4-[6-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]pyrimidin-4-yl]morpholine
SMILESc1ccc(CCN2CCN(c3cc(N4CCOCC4)ncn3)CC2)nc1
InChIInChI=1S/C19H26N6O/c1-2-5-20-17(3-1)4-6-23-7-9-24(10-8-23)18-15-19(22-16-21-18)25-11-13-26-14-12-25/h1-3,5,15-16H,4,6-14H2
InChIKeyGJUPUJVIOLSSLV-UHFFFAOYSA-N
MW354.46 g/mol
LogP1.07
Rot. Bonds5

About 4-[6-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]pyrimidin-4-yl]morpholine

4-[6-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]pyrimidin-4-yl]morpholine (PubChem CID 171326602) has the molecular formula C19H26N6O and a molecular weight of 354.46 g/mol. Its IUPAC name is 4-[6-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]pyrimidin-4-yl]morpholine.

Molecular Properties

Compound Name4-[6-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]pyrimidin-4-yl]morpholine
PubChem CID171326602
Molecular FormulaC19H26N6O
Molecular Weight354.46 g/mol
Exact Mass354.22
IUPAC Name4-[6-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]pyrimidin-4-yl]morpholine
SMILESc1ccc(CCN2CCN(c3cc(N4CCOCC4)ncn3)CC2)nc1
InChIInChI=1S/C19H26N6O/c1-2-5-20-17(3-1)4-6-23-7-9-24(10-8-23)18-15-19(22-16-21-18)25-11-13-26-14-12-25/h1-3,5,15-16H,4,6-14H2
InChIKeyGJUPUJVIOLSSLV-UHFFFAOYSA-N
XLogP1.07
TPSA57.62 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.46
LogP ≤ 51.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

4-[6-[4-(2-phenylethyl)piperazin-1-yl]pyrimidin-4-yl]morpholine
CID 122282526
4-[4-methyl-6-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]pyrimidin-2-yl]morpholine
CID 171326637
4-(3,5-dimethylpyrazol-1-yl)-6-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]pyrimidine
CID 171327083
4-[6-[4-(2-pyrazol-1-ylethyl)piperazin-1-yl]pyrimidin-4-yl]morpholine
CID 71874854
4-[2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]morpholine
CID 13345110
2-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]pyridine-4-carbonitrile
CID 33207768
6-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]pyridin-3-amine
CID 60892817
4-[6-[4-[2-(2-methylimidazol-1-yl)ethyl]piperazin-1-yl]pyrimidin-4-yl]morpholine
CID 166189579
4-[4-[2-(6-methyl-2-pyridinyl)ethyl]piperazin-1-yl]-6-pyrrolidin-1-ylpyrimidine
CID 171334065
4-[6-(1,3-dihydroisoindol-2-yl)pyrimidin-4-yl]morpholine
CID 122282690
4-(4-ethylpiperazin-1-yl)-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine
CID 112858073
3-(3,5-dimethylpyrazol-1-yl)-6-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]pyridazine
CID 171327082

Frequently Asked Questions

What is the IUPAC name of 4-[6-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]pyrimidin-4-yl]morpholine?
The IUPAC name of 4-[6-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]pyrimidin-4-yl]morpholine (CID 171326602) is 4-[6-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]pyrimidin-4-yl]morpholine.
What is the SMILES notation for 4-[6-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]pyrimidin-4-yl]morpholine?
The canonical SMILES for 4-[6-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]pyrimidin-4-yl]morpholine is c1ccc(CCN2CCN(c3cc(N4CCOCC4)ncn3)CC2)nc1.
What is the InChIKey of 4-[6-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]pyrimidin-4-yl]morpholine?
The InChIKey is GJUPUJVIOLSSLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N6O/c1-2-5-20-17(3-1)4-6-23-7-9-24(10-8-23)18-15-19(22-16-21-18)25-11-13-26-14-12-25/h1-3,5,15-16H,4,6-14H2.
What are the key properties of 4-[6-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]pyrimidin-4-yl]morpholine?
4-[6-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]pyrimidin-4-yl]morpholine has a molecular weight of 354.46 g/mol, XLogP of 1.07, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[6-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]pyrimidin-4-yl]morpholine is sourced from PubChem (CID 171326602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).