4-methylpiperazin-1-amine;1-methylpiperazine

C10H25N5 — CID 158167990

IUPAC4-methylpiperazin-1-amine;1-methylpiperazine
SMILESCN1CCN(N)CC1.CN1CCNCC1
InChIInChI=1S/C5H13N3.C5H12N2/c1-7-2-4-8(6)5-3-7;1-7-4-2-6-3-5-7/h2-6H2,1H3;6H,2-5H2,1H3
InChIKeyFXBVGYBHRUPVSR-UHFFFAOYSA-N
MW215.34 g/mol
LogP-1.37
Rot. Bonds

About 4-methylpiperazin-1-amine;1-methylpiperazine

4-methylpiperazin-1-amine;1-methylpiperazine (PubChem CID 158167990) has the molecular formula C10H25N5 and a molecular weight of 215.34 g/mol. Its IUPAC name is 4-methylpiperazin-1-amine;1-methylpiperazine.

Molecular Properties

Compound Name4-methylpiperazin-1-amine;1-methylpiperazine
PubChem CID158167990
Molecular FormulaC10H25N5
Molecular Weight215.34 g/mol
Exact Mass215.21
IUPAC Name4-methylpiperazin-1-amine;1-methylpiperazine
SMILESCN1CCN(N)CC1.CN1CCNCC1
InChIInChI=1S/C5H13N3.C5H12N2/c1-7-2-4-8(6)5-3-7;1-7-4-2-6-3-5-7/h2-6H2,1H3;6H,2-5H2,1H3
InChIKeyFXBVGYBHRUPVSR-UHFFFAOYSA-N
XLogP-1.37
TPSA47.77 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 5-1.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}

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Related Compounds

1,4,7,10-tetramethyl-1,4,7,10,13-pentazacyclopentadecane
CID 13461315
4-methylpiperazin-1-amine;hydrochloride
CID 19907612
1-methyl-1,4,7,10,13-pentazacyclopentadecane
CID 18705592
alumane;1-methylpiperazine
CID 173336720
ethane;1-methylpiperazine
CID 91350928
1-methylpiperazine;dihydrochloride
CID 2734715
1-methylpiperazine;hydrate
CID 23128681
4,7-dimethyl-1,4,7,10-tetrazacyclotridecane
CID 152746949
cyclopropane;1-methylpiperazine
CID 166166790
potassium;hydride;1-methylpiperazine
CID 174652278
ethane;methane;1-methylpiperazine
CID 142051303
ethane;4-[4-(4-methylpiperazin-1-yl)-6-piperazin-1-yl-1,3,5-triazin-2-yl]piperazin-1-amine
CID 142530052

Frequently Asked Questions

What is the IUPAC name of 4-methylpiperazin-1-amine;1-methylpiperazine?
The IUPAC name of 4-methylpiperazin-1-amine;1-methylpiperazine (CID 158167990) is 4-methylpiperazin-1-amine;1-methylpiperazine.
What is the SMILES notation for 4-methylpiperazin-1-amine;1-methylpiperazine?
The canonical SMILES for 4-methylpiperazin-1-amine;1-methylpiperazine is CN1CCN(N)CC1.CN1CCNCC1.
What is the InChIKey of 4-methylpiperazin-1-amine;1-methylpiperazine?
The InChIKey is FXBVGYBHRUPVSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13N3.C5H12N2/c1-7-2-4-8(6)5-3-7;1-7-4-2-6-3-5-7/h2-6H2,1H3;6H,2-5H2,1H3.
What are the key properties of 4-methylpiperazin-1-amine;1-methylpiperazine?
4-methylpiperazin-1-amine;1-methylpiperazine has a molecular weight of 215.34 g/mol, XLogP of -1.37, 0 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methylpiperazin-1-amine;1-methylpiperazine is sourced from PubChem (CID 158167990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).