N,N-diethyl-2-piperazin-1-yl-1-pyridin-3-ylethanamine

C15H26N4 — CID 82201783

IUPACN,N-diethyl-2-piperazin-1-yl-1-pyridin-3-ylethanamine
SMILESCCN(CC)C(CN1CCNCC1)c1cccnc1
InChIInChI=1S/C15H26N4/c1-3-19(4-2)15(14-6-5-7-17-12-14)13-18-10-8-16-9-11-18/h5-7,12,15-16H,3-4,8-11,13H2,1-2H3
InChIKeyQNIUMJYRSYLLEU-UHFFFAOYSA-N
MW262.40 g/mol
LogP1.37
Rot. Bonds6

About N,N-diethyl-2-piperazin-1-yl-1-pyridin-3-ylethanamine

N,N-diethyl-2-piperazin-1-yl-1-pyridin-3-ylethanamine (PubChem CID 82201783) has the molecular formula C15H26N4 and a molecular weight of 262.40 g/mol. Its IUPAC name is N,N-diethyl-2-piperazin-1-yl-1-pyridin-3-ylethanamine.

Molecular Properties

Compound NameN,N-diethyl-2-piperazin-1-yl-1-pyridin-3-ylethanamine
PubChem CID82201783
Molecular FormulaC15H26N4
Molecular Weight262.40 g/mol
Exact Mass262.22
IUPAC NameN,N-diethyl-2-piperazin-1-yl-1-pyridin-3-ylethanamine
SMILESCCN(CC)C(CN1CCNCC1)c1cccnc1
InChIInChI=1S/C15H26N4/c1-3-19(4-2)15(14-6-5-7-17-12-14)13-18-10-8-16-9-11-18/h5-7,12,15-16H,3-4,8-11,13H2,1-2H3
InChIKeyQNIUMJYRSYLLEU-UHFFFAOYSA-N
XLogP1.37
TPSA31.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N,N-diethyl-2-piperazin-1-yl-1-pyridin-3-ylethanamine 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

2-[methyl-(2-piperazin-1-yl-1-pyridin-3-ylethyl)amino]ethanol
CID 82201784
1-[(2R)-2-pyridin-3-ylpropyl]piperazine
CID 67593511
1-(2-piperazin-1-yl-1-pyridin-3-ylethyl)azepane
CID 82201767
1-[(1S)-1-pyridin-3-ylpropyl]piperazine
CID 92764058
1-(2,3-dihydro-1H-inden-5-yl)-N,N-diethyl-2-piperazin-1-ylethanamine
CID 82201862
1-[(1S)-1-pyridin-3-ylpentyl]piperazine
CID 171308841
N-[1-(4-chlorophenyl)-2-piperazin-1-ylethyl]-N-ethylbutan-1-amine
CID 82201682
1-(2-piperazin-1-yl-2-pyridin-3-ylethyl)piperidin-4-ol
CID 83978977
1-(2-phenyl-2-pyridin-4-ylethyl)piperazine
CID 70241433
3-(1-piperidin-4-ylpropyl)pyridine
CID 83908701
1-piperazin-1-yl-1-pyridin-3-ylpropan-2-ol
CID 82286657
1-[(1S)-2,2-dimethyl-1-pyridin-3-ylpropyl]piperazine;dihydrochloride
CID 171275055

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-piperazin-1-yl-1-pyridin-3-ylethanamine?
The IUPAC name of N,N-diethyl-2-piperazin-1-yl-1-pyridin-3-ylethanamine (CID 82201783) is N,N-diethyl-2-piperazin-1-yl-1-pyridin-3-ylethanamine.
What is the SMILES notation for N,N-diethyl-2-piperazin-1-yl-1-pyridin-3-ylethanamine?
The canonical SMILES for N,N-diethyl-2-piperazin-1-yl-1-pyridin-3-ylethanamine is CCN(CC)C(CN1CCNCC1)c1cccnc1.
What is the InChIKey of N,N-diethyl-2-piperazin-1-yl-1-pyridin-3-ylethanamine?
The InChIKey is QNIUMJYRSYLLEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4/c1-3-19(4-2)15(14-6-5-7-17-12-14)13-18-10-8-16-9-11-18/h5-7,12,15-16H,3-4,8-11,13H2,1-2H3.
What are the key properties of N,N-diethyl-2-piperazin-1-yl-1-pyridin-3-ylethanamine?
N,N-diethyl-2-piperazin-1-yl-1-pyridin-3-ylethanamine has a molecular weight of 262.40 g/mol, XLogP of 1.37, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-piperazin-1-yl-1-pyridin-3-ylethanamine is sourced from PubChem (CID 82201783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).