1-methylpiperazine;bis(piperidine);pyrrolidine

C19H43N5 — CID 164970111

IUPAC1-methylpiperazine;bis(piperidine);pyrrolidine
SMILESC1CCNC1.C1CCNCC1.C1CCNCC1.CN1CCNCC1
InChIInChI=1S/C5H12N2.2C5H11N.C4H9N/c1-7-4-2-6-3-5-7;2*1-2-4-6-5-3-1;1-2-4-5-3-1/h6H,2-5H2,1H3;2*6H,1-5H2;5H,1-4H2
InChIKeyCZUPSMKCBITMGS-UHFFFAOYSA-N
MW341.59 g/mol
LogP1.41
Rot. Bonds

About 1-methylpiperazine;bis(piperidine);pyrrolidine

1-methylpiperazine;bis(piperidine);pyrrolidine (PubChem CID 164970111) has the molecular formula C19H43N5 and a molecular weight of 341.59 g/mol. Its IUPAC name is 1-methylpiperazine;bis(piperidine);pyrrolidine.

Molecular Properties

Compound Name1-methylpiperazine;bis(piperidine);pyrrolidine
PubChem CID164970111
Molecular FormulaC19H43N5
Molecular Weight341.59 g/mol
Exact Mass341.35
IUPAC Name1-methylpiperazine;bis(piperidine);pyrrolidine
SMILESC1CCNC1.C1CCNCC1.C1CCNCC1.CN1CCNCC1
InChIInChI=1S/C5H12N2.2C5H11N.C4H9N/c1-7-4-2-6-3-5-7;2*1-2-4-6-5-3-1;1-2-4-5-3-1/h6H,2-5H2,1H3;2*6H,1-5H2;5H,1-4H2
InChIKeyCZUPSMKCBITMGS-UHFFFAOYSA-N
XLogP1.41
TPSA51.36 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.59
LogP ≤ 51.41
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

1-methylpiperazine;piperazine;piperidine;pyrrolidine
CID 158850243
cyclopropane;1-methylpiperazine
CID 166166790
4,7-dimethyl-1,4,7,10-tetrazacyclotridecane
CID 152746949
1-methyl-1,4-diazepane
CID 161378839
cyclopentane;N-methylmethanamine;1-methylpiperazine
CID 143761923
1,6-dimethyl-1,6,11,16-tetrazacycloicosane
CID 22113785
1-methyl-1,6,11,16-tetrazacycloicosane
CID 22113601
1,4,7,10-tetramethyl-1,4,7,10,13-pentazacyclopentadecane
CID 13461315
ethane;1-methylpiperazine
CID 91350928
alumane;1-methylpiperazine
CID 173336720
1-methyl-1,4,7,10,13-pentazacyclopentadecane
CID 18705592
1-methylpiperazine;dihydrochloride
CID 2734715

Frequently Asked Questions

What is the IUPAC name of 1-methylpiperazine;bis(piperidine);pyrrolidine?
The IUPAC name of 1-methylpiperazine;bis(piperidine);pyrrolidine (CID 164970111) is 1-methylpiperazine;bis(piperidine);pyrrolidine.
What is the SMILES notation for 1-methylpiperazine;bis(piperidine);pyrrolidine?
The canonical SMILES for 1-methylpiperazine;bis(piperidine);pyrrolidine is C1CCNC1.C1CCNCC1.C1CCNCC1.CN1CCNCC1.
What is the InChIKey of 1-methylpiperazine;bis(piperidine);pyrrolidine?
The InChIKey is CZUPSMKCBITMGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2.2C5H11N.C4H9N/c1-7-4-2-6-3-5-7;2*1-2-4-6-5-3-1;1-2-4-5-3-1/h6H,2-5H2,1H3;2*6H,1-5H2;5H,1-4H2.
What are the key properties of 1-methylpiperazine;bis(piperidine);pyrrolidine?
1-methylpiperazine;bis(piperidine);pyrrolidine has a molecular weight of 341.59 g/mol, XLogP of 1.41, 0 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methylpiperazine;bis(piperidine);pyrrolidine is sourced from PubChem (CID 164970111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).