1-cyclopropyl-2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]ethanamine

C13H28N4 — CID 63913476

IUPAC1-cyclopropyl-2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]ethanamine
SMILESCN(C)CCN1CCN(CC(N)C2CC2)CC1
InChIInChI=1S/C13H28N4/c1-15(2)5-6-16-7-9-17(10-8-16)11-13(14)12-3-4-12/h12-13H,3-11,14H2,1-2H3
InChIKeyBLWALYWPDCXNMZ-UHFFFAOYSA-N
MW240.39 g/mol
LogP-0.10
Rot. Bonds6

About 1-cyclopropyl-2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]ethanamine

1-cyclopropyl-2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]ethanamine (PubChem CID 63913476) has the molecular formula C13H28N4 and a molecular weight of 240.39 g/mol. Its IUPAC name is 1-cyclopropyl-2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]ethanamine.

Molecular Properties

Compound Name1-cyclopropyl-2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]ethanamine
PubChem CID63913476
Molecular FormulaC13H28N4
Molecular Weight240.39 g/mol
Exact Mass240.23
IUPAC Name1-cyclopropyl-2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]ethanamine
SMILESCN(C)CCN1CCN(CC(N)C2CC2)CC1
InChIInChI=1S/C13H28N4/c1-15(2)5-6-16-7-9-17(10-8-16)11-13(14)12-3-4-12/h12-13H,3-11,14H2,1-2H3
InChIKeyBLWALYWPDCXNMZ-UHFFFAOYSA-N
XLogP-0.10
TPSA35.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 5-0.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-4-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]butan-1-ol
CID 64899649
1-cyclopentyl-2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-N-methylethanamine
CID 104745994
2-(4-methylpiperazin-1-yl)-1-(thian-4-yl)ethanamine
CID 117238656
1-cyclohexyl-2-(4-ethylpiperazin-1-yl)ethanamine
CID 104744254
2-(4-cyclopentylpiperazin-1-yl)-1-cyclopropylethanamine
CID 63914772
N,N-dimethyl-2-(4-methylpiperazin-1-yl)ethanamine;ethane
CID 143417406
1-bromo-3-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]propan-2-ol
CID 112561591
1-cyclopentyl-2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-N-ethylethanamine
CID 104746000
1-cyclopentyl-2-piperidin-1-ylethanamine
CID 82399234
2-[4-(2,2-dimethoxyethyl)piperazin-1-yl]-N,N-dimethylethanamine
CID 66222136
1-cyclohexyl-2-(4-propan-2-ylpiperazin-1-yl)ethanamine
CID 113448062
2-[4-[2-(bromomethyl)-3-methylbutyl]piperazin-1-yl]-N,N-dimethylethanamine
CID 65012025

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]ethanamine?
The IUPAC name of 1-cyclopropyl-2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]ethanamine (CID 63913476) is 1-cyclopropyl-2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]ethanamine.
What is the SMILES notation for 1-cyclopropyl-2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]ethanamine?
The canonical SMILES for 1-cyclopropyl-2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]ethanamine is CN(C)CCN1CCN(CC(N)C2CC2)CC1.
What is the InChIKey of 1-cyclopropyl-2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]ethanamine?
The InChIKey is BLWALYWPDCXNMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N4/c1-15(2)5-6-16-7-9-17(10-8-16)11-13(14)12-3-4-12/h12-13H,3-11,14H2,1-2H3.
What are the key properties of 1-cyclopropyl-2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]ethanamine?
1-cyclopropyl-2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]ethanamine has a molecular weight of 240.39 g/mol, XLogP of -0.10, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]ethanamine is sourced from PubChem (CID 63913476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).