N-(2-piperazin-1-ylethyl)tetradecan-1-amine

C20H43N3 — CID 22706682

IUPACN-(2-piperazin-1-ylethyl)tetradecan-1-amine
SMILESCCCCCCCCCCCCCCNCCN1CCNCC1
InChIInChI=1S/C20H43N3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-21-15-18-23-19-16-22-17-20-23/h21-22H,2-20H2,1H3
InChIKeyVNRLJVFSOZUJNJ-UHFFFAOYSA-N
MW325.59 g/mol
LogP4.18
Rot. Bonds16

About N-(2-piperazin-1-ylethyl)tetradecan-1-amine

N-(2-piperazin-1-ylethyl)tetradecan-1-amine (PubChem CID 22706682) has the molecular formula C20H43N3 and a molecular weight of 325.59 g/mol. Its IUPAC name is N-(2-piperazin-1-ylethyl)tetradecan-1-amine.

Molecular Properties

Compound NameN-(2-piperazin-1-ylethyl)tetradecan-1-amine
PubChem CID22706682
Molecular FormulaC20H43N3
Molecular Weight325.59 g/mol
Exact Mass325.35
IUPAC NameN-(2-piperazin-1-ylethyl)tetradecan-1-amine
SMILESCCCCCCCCCCCCCCNCCN1CCNCC1
InChIInChI=1S/C20H43N3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-21-15-18-23-19-16-22-17-20-23/h21-22H,2-20H2,1H3
InChIKeyVNRLJVFSOZUJNJ-UHFFFAOYSA-N
XLogP4.18
TPSA27.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds16
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.59
LogP ≤ 54.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-(2-piperazin-1-ylethyl)tetradecan-1-amine 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

N-(2-piperazin-1-ylethyl)octan-1-amine
CID 115568684
N-(3-piperazin-1-ylpropyl)hexan-1-amine
CID 135182222
N-pentyl-6-piperazin-1-ylhexan-1-amine
CID 54403619
N-(3-piperazin-1-ylpropyl)pentan-1-amine
CID 67333838
N-[2-(azepan-1-yl)ethyl]hexan-1-amine
CID 61239608
N-(2-pyrrolidin-1-ylethyl)pentan-1-amine
CID 28654194
3-(aziridin-1-yl)-N-(2-piperazin-1-ylethyl)propan-1-amine
CID 544912
1-tricosylpiperazine
CID 130183651
ethane;1-octylpiperazine
CID 144711845
3-ethoxy-N-(2-piperazin-1-ylethyl)propan-1-amine
CID 139481440
diazanium;1-docosylpiperazine;dibromide
CID 157305429
N-(3-pyrrolidin-1-ylpropyl)heptan-1-amine
CID 43130243

Frequently Asked Questions

What is the IUPAC name of N-(2-piperazin-1-ylethyl)tetradecan-1-amine?
The IUPAC name of N-(2-piperazin-1-ylethyl)tetradecan-1-amine (CID 22706682) is N-(2-piperazin-1-ylethyl)tetradecan-1-amine.
What is the SMILES notation for N-(2-piperazin-1-ylethyl)tetradecan-1-amine?
The canonical SMILES for N-(2-piperazin-1-ylethyl)tetradecan-1-amine is CCCCCCCCCCCCCCNCCN1CCNCC1.
What is the InChIKey of N-(2-piperazin-1-ylethyl)tetradecan-1-amine?
The InChIKey is VNRLJVFSOZUJNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H43N3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-21-15-18-23-19-16-22-17-20-23/h21-22H,2-20H2,1H3.
What are the key properties of N-(2-piperazin-1-ylethyl)tetradecan-1-amine?
N-(2-piperazin-1-ylethyl)tetradecan-1-amine has a molecular weight of 325.59 g/mol, XLogP of 4.18, 16 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)tetradecan-1-amine is sourced from PubChem (CID 22706682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).