3,3-dipropylpiperazine-1,2,2-triamine

C10H25N5 — CID 67282456

IUPAC3,3-dipropylpiperazine-1,2,2-triamine
SMILESCCCC1(CCC)NCCN(N)C1(N)N
InChIInChI=1S/C10H25N5/c1-3-5-9(6-4-2)10(11,12)15(13)8-7-14-9/h14H,3-8,11-13H2,1-2H3
InChIKeyLYEXMUYGUBRELS-UHFFFAOYSA-N
MW215.34 g/mol
LogP-0.32
Rot. Bonds4

About 3,3-dipropylpiperazine-1,2,2-triamine

3,3-dipropylpiperazine-1,2,2-triamine (PubChem CID 67282456) has the molecular formula C10H25N5 and a molecular weight of 215.34 g/mol. Its IUPAC name is 3,3-dipropylpiperazine-1,2,2-triamine.

Molecular Properties

Compound Name3,3-dipropylpiperazine-1,2,2-triamine
PubChem CID67282456
Molecular FormulaC10H25N5
Molecular Weight215.34 g/mol
Exact Mass215.21
IUPAC Name3,3-dipropylpiperazine-1,2,2-triamine
SMILESCCCC1(CCC)NCCN(N)C1(N)N
InChIInChI=1S/C10H25N5/c1-3-5-9(6-4-2)10(11,12)15(13)8-7-14-9/h14H,3-8,11-13H2,1-2H3
InChIKeyLYEXMUYGUBRELS-UHFFFAOYSA-N
XLogP-0.32
TPSA93.33 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 5-0.32
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3,3-dipropylpiperazine-1,2,2-triamine?
The IUPAC name of 3,3-dipropylpiperazine-1,2,2-triamine (CID 67282456) is 3,3-dipropylpiperazine-1,2,2-triamine.
What is the SMILES notation for 3,3-dipropylpiperazine-1,2,2-triamine?
The canonical SMILES for 3,3-dipropylpiperazine-1,2,2-triamine is CCCC1(CCC)NCCN(N)C1(N)N.
What is the InChIKey of 3,3-dipropylpiperazine-1,2,2-triamine?
The InChIKey is LYEXMUYGUBRELS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H25N5/c1-3-5-9(6-4-2)10(11,12)15(13)8-7-14-9/h14H,3-8,11-13H2,1-2H3.
What are the key properties of 3,3-dipropylpiperazine-1,2,2-triamine?
3,3-dipropylpiperazine-1,2,2-triamine has a molecular weight of 215.34 g/mol, XLogP of -0.32, 4 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dipropylpiperazine-1,2,2-triamine is sourced from PubChem (CID 67282456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).