4-[5-[[4-(2-phenylethyl)piperazin-1-yl]methyl]-2-pyridinyl]morpholine

C22H30N4O — CID 24784906

IUPAC4-[5-[[4-(2-phenylethyl)piperazin-1-yl]methyl]-2-pyridinyl]morpholine
SMILESc1ccc(CCN2CCN(Cc3ccc(N4CCOCC4)nc3)CC2)cc1
InChIInChI=1S/C22H30N4O/c1-2-4-20(5-3-1)8-9-24-10-12-25(13-11-24)19-21-6-7-22(23-18-21)26-14-16-27-17-15-26/h1-7,18H,8-17,19H2
InChIKeyYTWFUMJRVAKZEB-UHFFFAOYSA-N
MW366.51 g/mol
LogP2.28
Rot. Bonds6

About 4-[5-[[4-(2-phenylethyl)piperazin-1-yl]methyl]-2-pyridinyl]morpholine

4-[5-[[4-(2-phenylethyl)piperazin-1-yl]methyl]-2-pyridinyl]morpholine (PubChem CID 24784906) has the molecular formula C22H30N4O and a molecular weight of 366.51 g/mol. Its IUPAC name is 4-[5-[[4-(2-phenylethyl)piperazin-1-yl]methyl]-2-pyridinyl]morpholine.

Molecular Properties

Compound Name4-[5-[[4-(2-phenylethyl)piperazin-1-yl]methyl]-2-pyridinyl]morpholine
PubChem CID24784906
Molecular FormulaC22H30N4O
Molecular Weight366.51 g/mol
Exact Mass366.24
IUPAC Name4-[5-[[4-(2-phenylethyl)piperazin-1-yl]methyl]-2-pyridinyl]morpholine
SMILESc1ccc(CCN2CCN(Cc3ccc(N4CCOCC4)nc3)CC2)cc1
InChIInChI=1S/C22H30N4O/c1-2-4-20(5-3-1)8-9-24-10-12-25(13-11-24)19-21-6-7-22(23-18-21)26-14-16-27-17-15-26/h1-7,18H,8-17,19H2
InChIKeyYTWFUMJRVAKZEB-UHFFFAOYSA-N
XLogP2.28
TPSA31.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.51
LogP ≤ 52.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-[6-[4-(2-phenylethyl)piperazin-1-yl]pyrimidin-4-yl]morpholine
CID 122282526
4-[2-[4-(2-phenylethyl)piperazin-1-yl]pyrimidin-4-yl]morpholine
CID 154829699
1-(5-methyl-2-pyridinyl)-4-(2-phenylethyl)piperazine
CID 171337954
1-benzyl-4-[5-(bromomethyl)-2-pyridinyl]piperazine
CID 107079127
methane;4-(2-phenylethyl)morpholine
CID 143698819
6-morpholin-4-yl-N-(2-phenylethyl)pyridin-3-amine
CID 43724739
2-(6-morpholin-4-yl-3-pyridinyl)ethanamine
CID 58882085
4-[[6-[3a-(2-phenylethyl)-1,2,3,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]-3-pyridinyl]methyl]morpholine
CID 137339195
1-(2-phenylethyl)-4-(pyridin-3-ylmethyl)piperazine;trihydrobromide
CID 68939346
N-benzyl-6-morpholin-4-ylpyridin-3-amine
CID 43724757
1-ethyl-4-[5-[(4-ethylpiperazin-1-yl)methyl]-2-pyridinyl]piperazine
CID 155403164
4-[5-(2-phenylethyl)pyrimidin-2-yl]morpholine
CID 138973898

Frequently Asked Questions

What is the IUPAC name of 4-[5-[[4-(2-phenylethyl)piperazin-1-yl]methyl]-2-pyridinyl]morpholine?
The IUPAC name of 4-[5-[[4-(2-phenylethyl)piperazin-1-yl]methyl]-2-pyridinyl]morpholine (CID 24784906) is 4-[5-[[4-(2-phenylethyl)piperazin-1-yl]methyl]-2-pyridinyl]morpholine.
What is the SMILES notation for 4-[5-[[4-(2-phenylethyl)piperazin-1-yl]methyl]-2-pyridinyl]morpholine?
The canonical SMILES for 4-[5-[[4-(2-phenylethyl)piperazin-1-yl]methyl]-2-pyridinyl]morpholine is c1ccc(CCN2CCN(Cc3ccc(N4CCOCC4)nc3)CC2)cc1.
What is the InChIKey of 4-[5-[[4-(2-phenylethyl)piperazin-1-yl]methyl]-2-pyridinyl]morpholine?
The InChIKey is YTWFUMJRVAKZEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H30N4O/c1-2-4-20(5-3-1)8-9-24-10-12-25(13-11-24)19-21-6-7-22(23-18-21)26-14-16-27-17-15-26/h1-7,18H,8-17,19H2.
What are the key properties of 4-[5-[[4-(2-phenylethyl)piperazin-1-yl]methyl]-2-pyridinyl]morpholine?
4-[5-[[4-(2-phenylethyl)piperazin-1-yl]methyl]-2-pyridinyl]morpholine has a molecular weight of 366.51 g/mol, XLogP of 2.28, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-[[4-(2-phenylethyl)piperazin-1-yl]methyl]-2-pyridinyl]morpholine is sourced from PubChem (CID 24784906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).