N'-[2-(1-piperazin-2-ylethylamino)ethyl]ethane-1,2-diamine

C10H25N5 — CID 156540184

IUPACN'-[2-(1-piperazin-2-ylethylamino)ethyl]ethane-1,2-diamine
SMILESCC(NCCNCCN)C1CNCCN1
InChIInChI=1S/C10H25N5/c1-9(10-8-13-5-7-15-10)14-6-4-12-3-2-11/h9-10,12-15H,2-8,11H2,1H3
InChIKeyDSPDOVLFKOVPAM-UHFFFAOYSA-N
MW215.34 g/mol
LogP-1.93
Rot. Bonds7

About N'-[2-(1-piperazin-2-ylethylamino)ethyl]ethane-1,2-diamine

N'-[2-(1-piperazin-2-ylethylamino)ethyl]ethane-1,2-diamine (PubChem CID 156540184) has the molecular formula C10H25N5 and a molecular weight of 215.34 g/mol. Its IUPAC name is N'-[2-(1-piperazin-2-ylethylamino)ethyl]ethane-1,2-diamine.

Molecular Properties

Compound NameN'-[2-(1-piperazin-2-ylethylamino)ethyl]ethane-1,2-diamine
PubChem CID156540184
Molecular FormulaC10H25N5
Molecular Weight215.34 g/mol
Exact Mass215.21
IUPAC NameN'-[2-(1-piperazin-2-ylethylamino)ethyl]ethane-1,2-diamine
SMILESCC(NCCNCCN)C1CNCCN1
InChIInChI=1S/C10H25N5/c1-9(10-8-13-5-7-15-10)14-6-4-12-3-2-11/h9-10,12-15H,2-8,11H2,1H3
InChIKeyDSPDOVLFKOVPAM-UHFFFAOYSA-N
XLogP-1.93
TPSA74.14 Ų
H-Bond Donors5
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 5-1.93
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-[2-(1-piperazin-2-ylethylamino)ethyl]ethane-1,2-diamine?
The IUPAC name of N'-[2-(1-piperazin-2-ylethylamino)ethyl]ethane-1,2-diamine (CID 156540184) is N'-[2-(1-piperazin-2-ylethylamino)ethyl]ethane-1,2-diamine.
What is the SMILES notation for N'-[2-(1-piperazin-2-ylethylamino)ethyl]ethane-1,2-diamine?
The canonical SMILES for N'-[2-(1-piperazin-2-ylethylamino)ethyl]ethane-1,2-diamine is CC(NCCNCCN)C1CNCCN1.
What is the InChIKey of N'-[2-(1-piperazin-2-ylethylamino)ethyl]ethane-1,2-diamine?
The InChIKey is DSPDOVLFKOVPAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H25N5/c1-9(10-8-13-5-7-15-10)14-6-4-12-3-2-11/h9-10,12-15H,2-8,11H2,1H3.
What are the key properties of N'-[2-(1-piperazin-2-ylethylamino)ethyl]ethane-1,2-diamine?
N'-[2-(1-piperazin-2-ylethylamino)ethyl]ethane-1,2-diamine has a molecular weight of 215.34 g/mol, XLogP of -1.93, 7 rotatable bonds, 5 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(1-piperazin-2-ylethylamino)ethyl]ethane-1,2-diamine is sourced from PubChem (CID 156540184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).