2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]pentan-1-amine

C13H30N4 — CID 62885074

IUPAC2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]pentan-1-amine
SMILESCCCC(CN)N1CCN(CCN(C)C)CC1
InChIInChI=1S/C13H30N4/c1-4-5-13(12-14)17-10-8-16(9-11-17)7-6-15(2)3/h13H,4-12,14H2,1-3H3
InChIKeyHZMRTHHHQAPKJF-UHFFFAOYSA-N
MW242.41 g/mol
LogP0.29
Rot. Bonds7

About 2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]pentan-1-amine

2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]pentan-1-amine (PubChem CID 62885074) has the molecular formula C13H30N4 and a molecular weight of 242.41 g/mol. Its IUPAC name is 2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]pentan-1-amine.

Molecular Properties

Compound Name2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]pentan-1-amine
PubChem CID62885074
Molecular FormulaC13H30N4
Molecular Weight242.41 g/mol
Exact Mass242.25
IUPAC Name2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]pentan-1-amine
SMILESCCCC(CN)N1CCN(CCN(C)C)CC1
InChIInChI=1S/C13H30N4/c1-4-5-13(12-14)17-10-8-16(9-11-17)7-6-15(2)3/h13H,4-12,14H2,1-3H3
InChIKeyHZMRTHHHQAPKJF-UHFFFAOYSA-N
XLogP0.29
TPSA35.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]pentan-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

2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]octan-1-amine
CID 62886437
3-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]pentan-1-amine
CID 43253206
2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-4,4-dimethylpentan-1-amine
CID 62951340
4-[4-(1-aminopentan-2-yl)piperazin-1-yl]butan-1-ol
CID 55202942
6-[4-(1-aminopentan-2-yl)piperazin-1-yl]hexan-1-ol
CID 107703012
2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-3-phenylpropan-1-amine
CID 62885238
3-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-2-methylbutan-1-amine
CID 79408430
2-[4-(1-aminopentan-2-yl)piperazin-1-yl]-N-methyl-N-propan-2-ylacetamide
CID 63343968
2-(4-methyl-1,4-diazepan-1-yl)pentan-1-amine
CID 43209332
3-[4-(1-aminopentan-2-yl)piperazin-1-yl]-N-propan-2-ylpropanamide
CID 63340321
N,N-dimethyl-2-[4-[(7Z,10Z,29Z,32Z)-nonatriaconta-7,10,29,32-tetraen-20-yl]piperazin-1-yl]ethanamine
CID 138486929
2-[4-(3-imidazol-1-ylpropyl)piperazin-1-yl]pentan-1-amine
CID 63343574

Frequently Asked Questions

What is the IUPAC name of 2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]pentan-1-amine?
The IUPAC name of 2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]pentan-1-amine (CID 62885074) is 2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]pentan-1-amine.
What is the SMILES notation for 2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]pentan-1-amine?
The canonical SMILES for 2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]pentan-1-amine is CCCC(CN)N1CCN(CCN(C)C)CC1.
What is the InChIKey of 2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]pentan-1-amine?
The InChIKey is HZMRTHHHQAPKJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H30N4/c1-4-5-13(12-14)17-10-8-16(9-11-17)7-6-15(2)3/h13H,4-12,14H2,1-3H3.
What are the key properties of 2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]pentan-1-amine?
2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]pentan-1-amine has a molecular weight of 242.41 g/mol, XLogP of 0.29, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]pentan-1-amine is sourced from PubChem (CID 62885074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).