N-(2-piperazin-1-ylethyl)prop-1-en-2-amine

C9H19N3 — CID 142030208

IUPACN-(2-piperazin-1-ylethyl)prop-1-en-2-amine
SMILESC=C(C)NCCN1CCNCC1
InChIInChI=1S/C9H19N3/c1-9(2)11-5-8-12-6-3-10-4-7-12/h10-11H,1,3-8H2,2H3
InChIKeyCGXQYZHCCGHTLE-UHFFFAOYSA-N
MW169.27 g/mol
LogP0.01
Rot. Bonds4

About N-(2-piperazin-1-ylethyl)prop-1-en-2-amine

N-(2-piperazin-1-ylethyl)prop-1-en-2-amine (PubChem CID 142030208) has the molecular formula C9H19N3 and a molecular weight of 169.27 g/mol. Its IUPAC name is N-(2-piperazin-1-ylethyl)prop-1-en-2-amine.

Molecular Properties

Compound NameN-(2-piperazin-1-ylethyl)prop-1-en-2-amine
PubChem CID142030208
Molecular FormulaC9H19N3
Molecular Weight169.27 g/mol
Exact Mass169.16
IUPAC NameN-(2-piperazin-1-ylethyl)prop-1-en-2-amine
SMILESC=C(C)NCCN1CCNCC1
InChIInChI=1S/C9H19N3/c1-9(2)11-5-8-12-6-3-10-4-7-12/h10-11H,1,3-8H2,2H3
InChIKeyCGXQYZHCCGHTLE-UHFFFAOYSA-N
XLogP0.01
TPSA27.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 50.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-piperazin-1-ylethyl)prop-1-en-2-amine?
The IUPAC name of N-(2-piperazin-1-ylethyl)prop-1-en-2-amine (CID 142030208) is N-(2-piperazin-1-ylethyl)prop-1-en-2-amine.
What is the SMILES notation for N-(2-piperazin-1-ylethyl)prop-1-en-2-amine?
The canonical SMILES for N-(2-piperazin-1-ylethyl)prop-1-en-2-amine is C=C(C)NCCN1CCNCC1.
What is the InChIKey of N-(2-piperazin-1-ylethyl)prop-1-en-2-amine?
The InChIKey is CGXQYZHCCGHTLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3/c1-9(2)11-5-8-12-6-3-10-4-7-12/h10-11H,1,3-8H2,2H3.
What are the key properties of N-(2-piperazin-1-ylethyl)prop-1-en-2-amine?
N-(2-piperazin-1-ylethyl)prop-1-en-2-amine has a molecular weight of 169.27 g/mol, XLogP of 0.01, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-piperazin-1-ylethyl)prop-1-en-2-amine is sourced from PubChem (CID 142030208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).