4-(4-ethylpiperazin-1-yl)-2,3-dihydropyridin-3-amine

C11H20N4 — CID 163687771

IUPAC4-(4-ethylpiperazin-1-yl)-2,3-dihydropyridin-3-amine
SMILESCCN1CCN(C2=CC=NCC2N)CC1
InChIInChI=1S/C11H20N4/c1-2-14-5-7-15(8-6-14)11-3-4-13-9-10(11)12/h3-4,10H,2,5-9,12H2,1H3
InChIKeyJQIJMHUDWBDBGC-UHFFFAOYSA-N
MW208.31 g/mol
LogP-0.08
Rot. Bonds2

About 4-(4-ethylpiperazin-1-yl)-2,3-dihydropyridin-3-amine

4-(4-ethylpiperazin-1-yl)-2,3-dihydropyridin-3-amine (PubChem CID 163687771) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is 4-(4-ethylpiperazin-1-yl)-2,3-dihydropyridin-3-amine.

Molecular Properties

Compound Name4-(4-ethylpiperazin-1-yl)-2,3-dihydropyridin-3-amine
PubChem CID163687771
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC Name4-(4-ethylpiperazin-1-yl)-2,3-dihydropyridin-3-amine
SMILESCCN1CCN(C2=CC=NCC2N)CC1
InChIInChI=1S/C11H20N4/c1-2-14-5-7-15(8-6-14)11-3-4-13-9-10(11)12/h3-4,10H,2,5-9,12H2,1H3
InChIKeyJQIJMHUDWBDBGC-UHFFFAOYSA-N
XLogP-0.08
TPSA44.86 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 5-0.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-methyl-5-piperazin-2-yl-2H-pyrazine
CID 53732754
5-(4-Ethylpiperazin-1-yl)-2,3-dihydropyridin-2-amine
CID 70889952
1-(2,3-Dihydropyridin-4-yl)-4-methylpiperazine
CID 123139522
(Z)-N-[(E)-1-(2-methylpiperazin-1-yl)prop-1-en-2-yl]pent-2-en-1-imine
CID 123800549
5-[1-(4-methylpiperazin-1-yl)ethenyl]-2H-pyrrol-3-amine
CID 129029104
(E)-N-[(Z)-but-2-en-2-yl]-3-piperazin-1-ylpent-3-en-1-imine
CID 134406002
6-(methylaminomethyl)-N-(1-prop-1-en-2-ylpiperidin-4-yl)-3,4-dihydropyridin-5-amine
CID 137506839
4-N-[2-(dimethylamino)ethyl]-3-methyl-2H-pyridine-3,4-diamine
CID 140591036
1-(3,4-Dihydropyridin-6-ylmethyl)piperazine;methanamine
CID 142252974
1-(3,4-Dihydropyridin-6-ylmethyl)piperazine
CID 142252975
(2R)-5-(4-propan-2-ylpiperazin-1-yl)-2,3-dihydropyridin-2-amine
CID 142400462
N,1-dimethyl-5-(prop-2-enylideneamino)-3,6-dihydro-2H-pyridin-4-amine
CID 144594832

Frequently Asked Questions

What is the IUPAC name of 4-(4-ethylpiperazin-1-yl)-2,3-dihydropyridin-3-amine?
The IUPAC name of 4-(4-ethylpiperazin-1-yl)-2,3-dihydropyridin-3-amine (CID 163687771) is 4-(4-ethylpiperazin-1-yl)-2,3-dihydropyridin-3-amine.
What is the SMILES notation for 4-(4-ethylpiperazin-1-yl)-2,3-dihydropyridin-3-amine?
The canonical SMILES for 4-(4-ethylpiperazin-1-yl)-2,3-dihydropyridin-3-amine is CCN1CCN(C2=CC=NCC2N)CC1.
What is the InChIKey of 4-(4-ethylpiperazin-1-yl)-2,3-dihydropyridin-3-amine?
The InChIKey is JQIJMHUDWBDBGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4/c1-2-14-5-7-15(8-6-14)11-3-4-13-9-10(11)12/h3-4,10H,2,5-9,12H2,1H3.
What are the key properties of 4-(4-ethylpiperazin-1-yl)-2,3-dihydropyridin-3-amine?
4-(4-ethylpiperazin-1-yl)-2,3-dihydropyridin-3-amine has a molecular weight of 208.31 g/mol, XLogP of -0.08, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-ethylpiperazin-1-yl)-2,3-dihydropyridin-3-amine is sourced from PubChem (CID 163687771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).