3-[1-(3-aminopropyl)piperazin-2-yl]propan-1-amine

C10H24N4 — CID 22056761

IUPAC3-[1-(3-aminopropyl)piperazin-2-yl]propan-1-amine
SMILESNCCCC1CNCCN1CCCN
InChIInChI=1S/C10H24N4/c11-4-1-3-10-9-13-6-8-14(10)7-2-5-12/h10,13H,1-9,11-12H2
InChIKeyMONKMMOKPDOZIP-UHFFFAOYSA-N
MW200.33 g/mol
LogP-0.65
Rot. Bonds6

About 3-[1-(3-aminopropyl)piperazin-2-yl]propan-1-amine

3-[1-(3-aminopropyl)piperazin-2-yl]propan-1-amine (PubChem CID 22056761) has the molecular formula C10H24N4 and a molecular weight of 200.33 g/mol. Its IUPAC name is 3-[1-(3-aminopropyl)piperazin-2-yl]propan-1-amine.

Molecular Properties

Compound Name3-[1-(3-aminopropyl)piperazin-2-yl]propan-1-amine
PubChem CID22056761
Molecular FormulaC10H24N4
Molecular Weight200.33 g/mol
Exact Mass200.20
IUPAC Name3-[1-(3-aminopropyl)piperazin-2-yl]propan-1-amine
SMILESNCCCC1CNCCN1CCCN
InChIInChI=1S/C10H24N4/c11-4-1-3-10-9-13-6-8-14(10)7-2-5-12/h10,13H,1-9,11-12H2
InChIKeyMONKMMOKPDOZIP-UHFFFAOYSA-N
XLogP-0.65
TPSA67.31 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 5-0.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[1-(3-aminopropyl)piperazin-2-yl]propan-1-amine?
The IUPAC name of 3-[1-(3-aminopropyl)piperazin-2-yl]propan-1-amine (CID 22056761) is 3-[1-(3-aminopropyl)piperazin-2-yl]propan-1-amine.
What is the SMILES notation for 3-[1-(3-aminopropyl)piperazin-2-yl]propan-1-amine?
The canonical SMILES for 3-[1-(3-aminopropyl)piperazin-2-yl]propan-1-amine is NCCCC1CNCCN1CCCN.
What is the InChIKey of 3-[1-(3-aminopropyl)piperazin-2-yl]propan-1-amine?
The InChIKey is MONKMMOKPDOZIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N4/c11-4-1-3-10-9-13-6-8-14(10)7-2-5-12/h10,13H,1-9,11-12H2.
What are the key properties of 3-[1-(3-aminopropyl)piperazin-2-yl]propan-1-amine?
3-[1-(3-aminopropyl)piperazin-2-yl]propan-1-amine has a molecular weight of 200.33 g/mol, XLogP of -0.65, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(3-aminopropyl)piperazin-2-yl]propan-1-amine is sourced from PubChem (CID 22056761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).