4-(2-piperazin-1-yl-2-piperidin-1-ylpyrrolidin-3-yl)morpholine

C17H33N5O — CID 91268362

IUPAC4-(2-piperazin-1-yl-2-piperidin-1-ylpyrrolidin-3-yl)morpholine
SMILESC1CCN(C2(N3CCNCC3)NCCC2N2CCOCC2)CC1
InChIInChI=1S/C17H33N5O/c1-2-8-21(9-3-1)17(22-10-6-18-7-11-22)16(4-5-19-17)20-12-14-23-15-13-20/h16,18-19H,1-15H2
InChIKeyWFAAIJKASYBCHY-UHFFFAOYSA-N
MW323.49 g/mol
LogP-0.27
Rot. Bonds3

About 4-(2-piperazin-1-yl-2-piperidin-1-ylpyrrolidin-3-yl)morpholine

4-(2-piperazin-1-yl-2-piperidin-1-ylpyrrolidin-3-yl)morpholine (PubChem CID 91268362) has the molecular formula C17H33N5O and a molecular weight of 323.49 g/mol. Its IUPAC name is 4-(2-piperazin-1-yl-2-piperidin-1-ylpyrrolidin-3-yl)morpholine.

Molecular Properties

Compound Name4-(2-piperazin-1-yl-2-piperidin-1-ylpyrrolidin-3-yl)morpholine
PubChem CID91268362
Molecular FormulaC17H33N5O
Molecular Weight323.49 g/mol
Exact Mass323.27
IUPAC Name4-(2-piperazin-1-yl-2-piperidin-1-ylpyrrolidin-3-yl)morpholine
SMILESC1CCN(C2(N3CCNCC3)NCCC2N2CCOCC2)CC1
InChIInChI=1S/C17H33N5O/c1-2-8-21(9-3-1)17(22-10-6-18-7-11-22)16(4-5-19-17)20-12-14-23-15-13-20/h16,18-19H,1-15H2
InChIKeyWFAAIJKASYBCHY-UHFFFAOYSA-N
XLogP-0.27
TPSA43.01 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.49
LogP ≤ 5-0.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-(2-Piperazin-1-ylpiperidin-2-yl)morpholine
CID 22460873
4-(3-Piperidin-1-yl-3-pyrrolidin-1-ylpiperazin-2-yl)morpholine
CID 53663701
4-(2-Piperidin-1-ylpiperazin-2-yl)morpholine
CID 54005229
4-(4-Methyl-2-piperazin-1-yl-3-piperidin-1-yl-3-pyrrolidin-1-ylpiperazin-2-yl)morpholine
CID 54485847
2,2-Di(piperidin-1-yl)-3-pyrrolidin-1-ylmorpholine
CID 56631290
1-morpholin-4-yl-N-[2-morpholin-4-yl-2-(3-piperidin-1-ylpropylamino)ethyl]propane-1,3-diamine
CID 57122865
N'-(2-amino-1-morpholin-4-ylethyl)-1-piperidin-1-yl-N-(2-piperidin-1-ylethyl)propane-1,3-diamine
CID 57161988
2-Piperazin-1-yl-2-piperidin-1-ylmorpholine
CID 57222581
3-Piperazin-1-yl-2-piperidin-1-yl-3-pyrrolidin-1-ylmorpholine
CID 90694084
3-Piperazin-1-yl-3-piperidin-1-ylmorpholine
CID 90735261
4-[3-(4-Methylpiperazin-1-yl)-2-piperidin-1-ylpiperidin-2-yl]morpholine
CID 90903170
4-[3-(4-Methylpiperazin-1-yl)-2-piperazin-1-ylpiperidin-2-yl]morpholine
CID 90903647

Frequently Asked Questions

What is the IUPAC name of 4-(2-piperazin-1-yl-2-piperidin-1-ylpyrrolidin-3-yl)morpholine?
The IUPAC name of 4-(2-piperazin-1-yl-2-piperidin-1-ylpyrrolidin-3-yl)morpholine (CID 91268362) is 4-(2-piperazin-1-yl-2-piperidin-1-ylpyrrolidin-3-yl)morpholine.
What is the SMILES notation for 4-(2-piperazin-1-yl-2-piperidin-1-ylpyrrolidin-3-yl)morpholine?
The canonical SMILES for 4-(2-piperazin-1-yl-2-piperidin-1-ylpyrrolidin-3-yl)morpholine is C1CCN(C2(N3CCNCC3)NCCC2N2CCOCC2)CC1.
What is the InChIKey of 4-(2-piperazin-1-yl-2-piperidin-1-ylpyrrolidin-3-yl)morpholine?
The InChIKey is WFAAIJKASYBCHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33N5O/c1-2-8-21(9-3-1)17(22-10-6-18-7-11-22)16(4-5-19-17)20-12-14-23-15-13-20/h16,18-19H,1-15H2.
What are the key properties of 4-(2-piperazin-1-yl-2-piperidin-1-ylpyrrolidin-3-yl)morpholine?
4-(2-piperazin-1-yl-2-piperidin-1-ylpyrrolidin-3-yl)morpholine has a molecular weight of 323.49 g/mol, XLogP of -0.27, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-piperazin-1-yl-2-piperidin-1-ylpyrrolidin-3-yl)morpholine is sourced from PubChem (CID 91268362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).