2-(2-pyridin-3-ylpiperazin-1-yl)ethanamine

C11H18N4 — CID 120754253

IUPAC2-(2-pyridin-3-ylpiperazin-1-yl)ethanamine
SMILESNCCN1CCNCC1c1cccnc1
InChIInChI=1S/C11H18N4/c12-3-6-15-7-5-14-9-11(15)10-2-1-4-13-8-10/h1-2,4,8,11,14H,3,5-7,9,12H2
InChIKeyFDFZMMWEYIONHE-UHFFFAOYSA-N
MW206.29 g/mol
LogP-0.01
Rot. Bonds3

About 2-(2-pyridin-3-ylpiperazin-1-yl)ethanamine

2-(2-pyridin-3-ylpiperazin-1-yl)ethanamine (PubChem CID 120754253) has the molecular formula C11H18N4 and a molecular weight of 206.29 g/mol. Its IUPAC name is 2-(2-pyridin-3-ylpiperazin-1-yl)ethanamine.

Molecular Properties

Compound Name2-(2-pyridin-3-ylpiperazin-1-yl)ethanamine
PubChem CID120754253
Molecular FormulaC11H18N4
Molecular Weight206.29 g/mol
Exact Mass206.15
IUPAC Name2-(2-pyridin-3-ylpiperazin-1-yl)ethanamine
SMILESNCCN1CCNCC1c1cccnc1
InChIInChI=1S/C11H18N4/c12-3-6-15-7-5-14-9-11(15)10-2-1-4-13-8-10/h1-2,4,8,11,14H,3,5-7,9,12H2
InChIKeyFDFZMMWEYIONHE-UHFFFAOYSA-N
XLogP-0.01
TPSA54.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 5-0.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-pyridin-3-yl-1-(2-pyridin-3-ylethyl)piperazine;dihydrochloride
CID 120755310
1-[2-(4-ethylphenyl)ethyl]-2-pyridin-3-ylpiperazine
CID 120755914
2-pyridin-3-yl-1-(pyridin-4-ylmethyl)piperazine
CID 120768078
N-methyl-N-[2-(2-pyridin-3-ylpiperazin-1-yl)ethyl]aniline
CID 120756006
1-prop-2-enyl-2-pyridin-3-ylpiperazine;hydrochloride
CID 120754736
1-[(4-fluorophenyl)methyl]-2-pyridin-3-ylpiperazine;hydrochloride
CID 120754578
1-[(4-bromophenyl)methyl]-2-pyridin-3-ylpiperazine
CID 120755894
1-[(3-bromophenyl)methyl]-2-pyridin-3-ylpiperazine
CID 120768370
1-(2-benzhydryloxyethyl)-2-pyridin-3-ylpiperazine;hydrochloride
CID 120754776
1-[2-(2,5-dichlorophenoxy)ethyl]-2-pyridin-3-ylpiperazine
CID 120756020
4-[2-(2-pyridin-3-ylpiperazin-1-yl)ethoxy]benzenesulfonamide
CID 120755301
1-[(2,6-dimethylphenyl)methyl]-2-pyridin-3-ylpiperazine;hydrochloride
CID 120754734

Frequently Asked Questions

What is the IUPAC name of 2-(2-pyridin-3-ylpiperazin-1-yl)ethanamine?
The IUPAC name of 2-(2-pyridin-3-ylpiperazin-1-yl)ethanamine (CID 120754253) is 2-(2-pyridin-3-ylpiperazin-1-yl)ethanamine.
What is the SMILES notation for 2-(2-pyridin-3-ylpiperazin-1-yl)ethanamine?
The canonical SMILES for 2-(2-pyridin-3-ylpiperazin-1-yl)ethanamine is NCCN1CCNCC1c1cccnc1.
What is the InChIKey of 2-(2-pyridin-3-ylpiperazin-1-yl)ethanamine?
The InChIKey is FDFZMMWEYIONHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4/c12-3-6-15-7-5-14-9-11(15)10-2-1-4-13-8-10/h1-2,4,8,11,14H,3,5-7,9,12H2.
What are the key properties of 2-(2-pyridin-3-ylpiperazin-1-yl)ethanamine?
2-(2-pyridin-3-ylpiperazin-1-yl)ethanamine has a molecular weight of 206.29 g/mol, XLogP of -0.01, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-pyridin-3-ylpiperazin-1-yl)ethanamine is sourced from PubChem (CID 120754253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).