4-piperazin-1-yl-3-piperidin-1-yl-3-pyrrolidin-1-ylmorpholin-2-amine

C17H34N6O — CID 140995718

IUPAC4-piperazin-1-yl-3-piperidin-1-yl-3-pyrrolidin-1-ylmorpholin-2-amine
SMILESNC1OCCN(N2CCNCC2)C1(N1CCCCC1)N1CCCC1
InChIInChI=1S/C17H34N6O/c18-16-17(21-10-4-5-11-21,20-8-2-1-3-9-20)23(14-15-24-16)22-12-6-19-7-13-22/h16,19H,1-15,18H2
InChIKeyRBVORLFLMCEQPJ-UHFFFAOYSA-N
MW338.50 g/mol
LogP-0.34
Rot. Bonds3

About 4-piperazin-1-yl-3-piperidin-1-yl-3-pyrrolidin-1-ylmorpholin-2-amine

4-piperazin-1-yl-3-piperidin-1-yl-3-pyrrolidin-1-ylmorpholin-2-amine (PubChem CID 140995718) has the molecular formula C17H34N6O and a molecular weight of 338.50 g/mol. Its IUPAC name is 4-piperazin-1-yl-3-piperidin-1-yl-3-pyrrolidin-1-ylmorpholin-2-amine.

Molecular Properties

Compound Name4-piperazin-1-yl-3-piperidin-1-yl-3-pyrrolidin-1-ylmorpholin-2-amine
PubChem CID140995718
Molecular FormulaC17H34N6O
Molecular Weight338.50 g/mol
Exact Mass338.28
IUPAC Name4-piperazin-1-yl-3-piperidin-1-yl-3-pyrrolidin-1-ylmorpholin-2-amine
SMILESNC1OCCN(N2CCNCC2)C1(N1CCCCC1)N1CCCC1
InChIInChI=1S/C17H34N6O/c18-16-17(21-10-4-5-11-21,20-8-2-1-3-9-20)23(14-15-24-16)22-12-6-19-7-13-22/h16,19H,1-15,18H2
InChIKeyRBVORLFLMCEQPJ-UHFFFAOYSA-N
XLogP-0.34
TPSA60.24 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.50
LogP ≤ 5-0.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

4-(3-Piperidin-1-yl-3-pyrrolidin-1-ylpiperazin-2-yl)morpholine
CID 53663701
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-N'-ethyl-1-N",2-dimorpholin-4-yl-1-N'-piperidin-1-yl-1-N"-propylethane-1,1,1-triamine
CID 57118991
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
4-(2-Piperazin-1-yl-2-piperidin-1-ylpyrrolidin-3-yl)morpholine
CID 91268362
1-N,1-N'-diethyl-1-N"-(1-methylpiperidin-1-ium-1-yl)-3-morpholin-4-yl-1-N-piperidin-1-yl-1-N"-propyl-1-N'-pyrrolidin-1-ylpropane-1,1,1,3-tetramine
CID 91461042
2-(4-Methylpiperazin-1-yl)-3-piperazin-1-yl-3-piperidin-1-yl-2-pyrrolidin-1-ylmorpholine
CID 123334449
4-Piperazin-1-yl-3-piperidin-1-ylmorpholine
CID 140974046

Frequently Asked Questions

What is the IUPAC name of 4-piperazin-1-yl-3-piperidin-1-yl-3-pyrrolidin-1-ylmorpholin-2-amine?
The IUPAC name of 4-piperazin-1-yl-3-piperidin-1-yl-3-pyrrolidin-1-ylmorpholin-2-amine (CID 140995718) is 4-piperazin-1-yl-3-piperidin-1-yl-3-pyrrolidin-1-ylmorpholin-2-amine.
What is the SMILES notation for 4-piperazin-1-yl-3-piperidin-1-yl-3-pyrrolidin-1-ylmorpholin-2-amine?
The canonical SMILES for 4-piperazin-1-yl-3-piperidin-1-yl-3-pyrrolidin-1-ylmorpholin-2-amine is NC1OCCN(N2CCNCC2)C1(N1CCCCC1)N1CCCC1.
What is the InChIKey of 4-piperazin-1-yl-3-piperidin-1-yl-3-pyrrolidin-1-ylmorpholin-2-amine?
The InChIKey is RBVORLFLMCEQPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N6O/c18-16-17(21-10-4-5-11-21,20-8-2-1-3-9-20)23(14-15-24-16)22-12-6-19-7-13-22/h16,19H,1-15,18H2.
What are the key properties of 4-piperazin-1-yl-3-piperidin-1-yl-3-pyrrolidin-1-ylmorpholin-2-amine?
4-piperazin-1-yl-3-piperidin-1-yl-3-pyrrolidin-1-ylmorpholin-2-amine has a molecular weight of 338.50 g/mol, XLogP of -0.34, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-piperazin-1-yl-3-piperidin-1-yl-3-pyrrolidin-1-ylmorpholin-2-amine is sourced from PubChem (CID 140995718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).