1-(2,3-dihydropyridin-5-yl)piperazine

C9H15N3 — CID 123318948

IUPAC1-(2,3-dihydropyridin-5-yl)piperazine
SMILESC1=NCCC=C1N1CCNCC1
InChIInChI=1S/C9H15N3/c1-2-9(8-11-3-1)12-6-4-10-5-7-12/h2,8,10H,1,3-7H2
InChIKeyGCCRINIPXJAGFL-UHFFFAOYSA-N
MW165.24 g/mol
LogP0.25
Rot. Bonds1

About 1-(2,3-dihydropyridin-5-yl)piperazine

1-(2,3-dihydropyridin-5-yl)piperazine (PubChem CID 123318948) has the molecular formula C9H15N3 and a molecular weight of 165.24 g/mol. Its IUPAC name is 1-(2,3-dihydropyridin-5-yl)piperazine.

Molecular Properties

Compound Name1-(2,3-dihydropyridin-5-yl)piperazine
PubChem CID123318948
Molecular FormulaC9H15N3
Molecular Weight165.24 g/mol
Exact Mass165.13
IUPAC Name1-(2,3-dihydropyridin-5-yl)piperazine
SMILESC1=NCCC=C1N1CCNCC1
InChIInChI=1S/C9H15N3/c1-2-9(8-11-3-1)12-6-4-10-5-7-12/h2,8,10H,1,3-7H2
InChIKeyGCCRINIPXJAGFL-UHFFFAOYSA-N
XLogP0.25
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 50.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(4-Ethylpiperazin-1-yl)-2,3-dihydropyridin-2-amine
CID 70889952
2-Piperazin-1-ylbut-2-en-1-imine
CID 123781310
(Z)-N-[(E)-1-(2-methylpiperazin-1-yl)prop-1-en-2-yl]pent-2-en-1-imine
CID 123800549
N-ethyl-2-piperazin-1-ylbut-2-en-1-imine
CID 124033166
(E)-N-[(Z)-but-2-en-2-yl]-2-piperazin-1-ylbut-2-en-1-imine
CID 134405853
(E)-N-[(Z)-but-2-en-2-yl]-3-piperazin-1-ylpent-3-en-1-imine
CID 134406002
2-methyl-6-piperazin-1-yl-4H-azepine
CID 134406048
(E)-2-piperazin-1-yl-N-prop-1-en-2-ylbut-2-en-1-imine
CID 134406060
(2E,5E)-N-methyl-2-piperazin-1-ylhepta-2,5-dien-1-imine
CID 134406064
N-[(Z)-but-2-en-2-yl]-2-piperazin-1-ylprop-2-en-1-imine
CID 134406734
1-(3,4-Dihydropyridin-6-ylmethyl)piperazine;methanamine
CID 142252974
1-(3,4-Dihydropyridin-6-ylmethyl)piperazine
CID 142252975

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydropyridin-5-yl)piperazine?
The IUPAC name of 1-(2,3-dihydropyridin-5-yl)piperazine (CID 123318948) is 1-(2,3-dihydropyridin-5-yl)piperazine.
What is the SMILES notation for 1-(2,3-dihydropyridin-5-yl)piperazine?
The canonical SMILES for 1-(2,3-dihydropyridin-5-yl)piperazine is C1=NCCC=C1N1CCNCC1.
What is the InChIKey of 1-(2,3-dihydropyridin-5-yl)piperazine?
The InChIKey is GCCRINIPXJAGFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3/c1-2-9(8-11-3-1)12-6-4-10-5-7-12/h2,8,10H,1,3-7H2.
What are the key properties of 1-(2,3-dihydropyridin-5-yl)piperazine?
1-(2,3-dihydropyridin-5-yl)piperazine has a molecular weight of 165.24 g/mol, XLogP of 0.25, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydropyridin-5-yl)piperazine is sourced from PubChem (CID 123318948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).