piperidine-2,2,6,6-tetramine

C5H15N5 — CID 158380817

IUPACpiperidine-2,2,6,6-tetramine
SMILESNC1(N)CCCC(N)(N)N1
InChIInChI=1S/C5H15N5/c6-4(7)2-1-3-5(8,9)10-4/h10H,1-3,6-9H2
InChIKeyGVTNORMDPJICTF-UHFFFAOYSA-N
MW145.21 g/mol
LogP-2.10
Rot. Bonds

About piperidine-2,2,6,6-tetramine

piperidine-2,2,6,6-tetramine (PubChem CID 158380817) has the molecular formula C5H15N5 and a molecular weight of 145.21 g/mol. Its IUPAC name is piperidine-2,2,6,6-tetramine.

Molecular Properties

Compound Namepiperidine-2,2,6,6-tetramine
PubChem CID158380817
Molecular FormulaC5H15N5
Molecular Weight145.21 g/mol
Exact Mass145.13
IUPAC Namepiperidine-2,2,6,6-tetramine
SMILESNC1(N)CCCC(N)(N)N1
InChIInChI=1S/C5H15N5/c6-4(7)2-1-3-5(8,9)10-4/h10H,1-3,6-9H2
InChIKeyGVTNORMDPJICTF-UHFFFAOYSA-N
XLogP-2.10
TPSA116.11 Ų
H-Bond Donors5
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.21
LogP ≤ 5-2.10
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of piperidine-2,2,6,6-tetramine?
The IUPAC name of piperidine-2,2,6,6-tetramine (CID 158380817) is piperidine-2,2,6,6-tetramine.
What is the SMILES notation for piperidine-2,2,6,6-tetramine?
The canonical SMILES for piperidine-2,2,6,6-tetramine is NC1(N)CCCC(N)(N)N1.
What is the InChIKey of piperidine-2,2,6,6-tetramine?
The InChIKey is GVTNORMDPJICTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H15N5/c6-4(7)2-1-3-5(8,9)10-4/h10H,1-3,6-9H2.
What are the key properties of piperidine-2,2,6,6-tetramine?
piperidine-2,2,6,6-tetramine has a molecular weight of 145.21 g/mol, XLogP of -2.10, 0 rotatable bonds, 5 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for piperidine-2,2,6,6-tetramine is sourced from PubChem (CID 158380817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).