2-(4-pyridin-4-ylpiperazin-1-yl)ethanamine

C11H18N4 — CID 18440675

IUPAC2-(4-pyridin-4-ylpiperazin-1-yl)ethanamine
SMILESNCCN1CCN(c2ccncc2)CC1
InChIInChI=1S/C11H18N4/c12-3-6-14-7-9-15(10-8-14)11-1-4-13-5-2-11/h1-2,4-5H,3,6-10,12H2
InChIKeyJYQXMQBFAUXDOF-UHFFFAOYSA-N
MW206.29 g/mol
LogP0.16
Rot. Bonds3

About 2-(4-pyridin-4-ylpiperazin-1-yl)ethanamine

2-(4-pyridin-4-ylpiperazin-1-yl)ethanamine (PubChem CID 18440675) has the molecular formula C11H18N4 and a molecular weight of 206.29 g/mol. Its IUPAC name is 2-(4-pyridin-4-ylpiperazin-1-yl)ethanamine.

Molecular Properties

Compound Name2-(4-pyridin-4-ylpiperazin-1-yl)ethanamine
PubChem CID18440675
Molecular FormulaC11H18N4
Molecular Weight206.29 g/mol
Exact Mass206.15
IUPAC Name2-(4-pyridin-4-ylpiperazin-1-yl)ethanamine
SMILESNCCN1CCN(c2ccncc2)CC1
InChIInChI=1S/C11H18N4/c12-3-6-14-7-9-15(10-8-14)11-1-4-13-5-2-11/h1-2,4-5H,3,6-10,12H2
InChIKeyJYQXMQBFAUXDOF-UHFFFAOYSA-N
XLogP0.16
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 50.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(1-methylpiperidin-4-yl)ethyl]-4-pyridin-4-ylpiperazine
CID 143388333
1-ethyl-4-pyridin-4-yl-1,4-diazepane
CID 121451794
3-amino-1-(4-pyridin-4-ylpiperazin-1-yl)propan-1-one
CID 22945719
2-[4-(4-nitrophenyl)piperazin-1-yl]ethanamine
CID 28913887
ethyl 5-(4-pyridin-4-ylpiperazin-1-yl)pentanoate
CID 21462657
4-pyrrolidin-1-ylpyridine
CID 158456628
3-[4-(4-pyrrolidin-1-ylphenyl)piperazin-1-yl]propan-1-amine
CID 82346723
2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanamine;dihydrochloride
CID 46736988
2-[4-[(R)-phenyl(pyridin-4-yl)methyl]piperazin-1-yl]ethanamine
CID 174413644
2-[4-[4-[(E)-2-pyridin-4-ylethenyl]phenyl]piperazin-1-yl]ethanol
CID 175001493
2-(4-pyridin-2-ylpiperazin-1-yl)ethanamine;tetrahydrochloride
CID 23627586
4-(aminomethyl)-1-pyridin-4-ylpiperidine-4-carboxylic acid
CID 18536528

Frequently Asked Questions

What is the IUPAC name of 2-(4-pyridin-4-ylpiperazin-1-yl)ethanamine?
The IUPAC name of 2-(4-pyridin-4-ylpiperazin-1-yl)ethanamine (CID 18440675) is 2-(4-pyridin-4-ylpiperazin-1-yl)ethanamine.
What is the SMILES notation for 2-(4-pyridin-4-ylpiperazin-1-yl)ethanamine?
The canonical SMILES for 2-(4-pyridin-4-ylpiperazin-1-yl)ethanamine is NCCN1CCN(c2ccncc2)CC1.
What is the InChIKey of 2-(4-pyridin-4-ylpiperazin-1-yl)ethanamine?
The InChIKey is JYQXMQBFAUXDOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4/c12-3-6-14-7-9-15(10-8-14)11-1-4-13-5-2-11/h1-2,4-5H,3,6-10,12H2.
What are the key properties of 2-(4-pyridin-4-ylpiperazin-1-yl)ethanamine?
2-(4-pyridin-4-ylpiperazin-1-yl)ethanamine has a molecular weight of 206.29 g/mol, XLogP of 0.16, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-pyridin-4-ylpiperazin-1-yl)ethanamine is sourced from PubChem (CID 18440675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).