1-(1-piperazin-1-ylpentan-3-yl)piperazine

C13H28N4 — CID 57104516

IUPAC1-(1-piperazin-1-ylpentan-3-yl)piperazine
SMILESCCC(CCN1CCNCC1)N1CCNCC1
InChIInChI=1S/C13H28N4/c1-2-13(17-11-6-15-7-12-17)3-8-16-9-4-14-5-10-16/h13-15H,2-12H2,1H3
InChIKeyMQKFMFGXAGDQFU-UHFFFAOYSA-N
MW240.39 g/mol
LogP-0.03
Rot. Bonds5

About 1-(1-piperazin-1-ylpentan-3-yl)piperazine

1-(1-piperazin-1-ylpentan-3-yl)piperazine (PubChem CID 57104516) has the molecular formula C13H28N4 and a molecular weight of 240.39 g/mol. Its IUPAC name is 1-(1-piperazin-1-ylpentan-3-yl)piperazine.

Molecular Properties

Compound Name1-(1-piperazin-1-ylpentan-3-yl)piperazine
PubChem CID57104516
Molecular FormulaC13H28N4
Molecular Weight240.39 g/mol
Exact Mass240.23
IUPAC Name1-(1-piperazin-1-ylpentan-3-yl)piperazine
SMILESCCC(CCN1CCNCC1)N1CCNCC1
InChIInChI=1S/C13H28N4/c1-2-13(17-11-6-15-7-12-17)3-8-16-9-4-14-5-10-16/h13-15H,2-12H2,1H3
InChIKeyMQKFMFGXAGDQFU-UHFFFAOYSA-N
XLogP-0.03
TPSA30.54 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 5-0.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-(1-piperazin-1-ylpentan-3-yl)piperazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[(3R)-hexan-3-yl]piperazine
CID 94350939
1-(3-methylpentyl)piperazine
CID 45099566
N-methyl-1-piperazin-1-ylpentan-3-amine
CID 116954941
4-piperazin-1-ylbutan-2-ol;dihydrochloride
CID 141116403
fluoromethane;1-(1-methoxybutan-2-yl)piperazine
CID 162038929
4-methyl-1-piperazin-1-ylpentan-3-amine
CID 116939882
1-(8-methylnonyl)piperazine
CID 170614920
hydron;1-propylpiperazine;dibromide
CID 91980567
ethanol;1-(3-methoxybutyl)-1,4,7-triazonane
CID 70236952
1-ethylpiperazine;1-propan-2-ylpiperazine
CID 70370755
1-[2-(4-butan-2-ylpiperazin-1-yl)ethyl]-1,4-diazepane
CID 62832597
1-(1-bromopropyl)piperazine
CID 135292234

Frequently Asked Questions

What is the IUPAC name of 1-(1-piperazin-1-ylpentan-3-yl)piperazine?
The IUPAC name of 1-(1-piperazin-1-ylpentan-3-yl)piperazine (CID 57104516) is 1-(1-piperazin-1-ylpentan-3-yl)piperazine.
What is the SMILES notation for 1-(1-piperazin-1-ylpentan-3-yl)piperazine?
The canonical SMILES for 1-(1-piperazin-1-ylpentan-3-yl)piperazine is CCC(CCN1CCNCC1)N1CCNCC1.
What is the InChIKey of 1-(1-piperazin-1-ylpentan-3-yl)piperazine?
The InChIKey is MQKFMFGXAGDQFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N4/c1-2-13(17-11-6-15-7-12-17)3-8-16-9-4-14-5-10-16/h13-15H,2-12H2,1H3.
What are the key properties of 1-(1-piperazin-1-ylpentan-3-yl)piperazine?
1-(1-piperazin-1-ylpentan-3-yl)piperazine has a molecular weight of 240.39 g/mol, XLogP of -0.03, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-piperazin-1-ylpentan-3-yl)piperazine is sourced from PubChem (CID 57104516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).