1-(2,3-dihydro-1H-inden-2-yl)piperazine;dihydrochloride

C13H20Cl2N2 — CID 50944348

IUPAC1-(2,3-dihydro-1H-inden-2-yl)piperazine;dihydrochloride
SMILESCl.Cl.c1ccc2c(c1)CC(N1CCNCC1)C2
InChIInChI=1S/C13H18N2.2ClH/c1-2-4-12-10-13(9-11(12)3-1)15-7-5-14-6-8-15;;/h1-4,13-14H,5-10H2;2*1H
InChIKeyCHXVIAWGVGKXPO-UHFFFAOYSA-N
MW275.22 g/mol
LogP1.90
Rot. Bonds1

About 1-(2,3-dihydro-1H-inden-2-yl)piperazine;dihydrochloride

1-(2,3-dihydro-1H-inden-2-yl)piperazine;dihydrochloride (PubChem CID 50944348) has the molecular formula C13H20Cl2N2 and a molecular weight of 275.22 g/mol. Its IUPAC name is 1-(2,3-dihydro-1H-inden-2-yl)piperazine;dihydrochloride.

Molecular Properties

Compound Name1-(2,3-dihydro-1H-inden-2-yl)piperazine;dihydrochloride
PubChem CID50944348
Molecular FormulaC13H20Cl2N2
Molecular Weight275.22 g/mol
Exact Mass274.10
IUPAC Name1-(2,3-dihydro-1H-inden-2-yl)piperazine;dihydrochloride
SMILESCl.Cl.c1ccc2c(c1)CC(N1CCNCC1)C2
InChIInChI=1S/C13H18N2.2ClH/c1-2-4-12-10-13(9-11(12)3-1)15-7-5-14-6-8-15;;/h1-4,13-14H,5-10H2;2*1H
InChIKeyCHXVIAWGVGKXPO-UHFFFAOYSA-N
XLogP1.90
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.22
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,3-dihydro-1H-inden-2-yl)piperazine
CID 22648168
1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperazine
CID 3596803
(2R)-2-piperazin-1-yl-2,3-dihydro-1H-indene-5-carbonitrile
CID 129388309
1-(5-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl)piperazine
CID 84627868
1,4-diazepan-1-yl-[1-[1-(2,3-dihydro-1H-inden-2-yl)piperidin-4-yl]piperidin-3-yl]methanone;dihydrochloride
CID 154896845
(7R)-7-piperazin-1-yl-5,6,7,8-tetrahydronaphthalen-1-ol
CID 59144793
1-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)piperazine;dihydrochloride
CID 67828788
1-(1-phenylpiperidin-4-yl)piperazine
CID 2737157
3-cyclohexyl-1-(2,3-dihydro-1H-inden-2-yl)piperazine
CID 107854036
1-[(1S)-2,3-dihydro-1H-inden-1-yl]piperazine
CID 30634298
2-[4-(2,3-dihydro-1H-inden-2-yl)piperazin-1-yl]pyrimidine
CID 30982970
1-(4-phenylcyclohexyl)piperazine chloride
CID 53347254

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1H-inden-2-yl)piperazine;dihydrochloride?
The IUPAC name of 1-(2,3-dihydro-1H-inden-2-yl)piperazine;dihydrochloride (CID 50944348) is 1-(2,3-dihydro-1H-inden-2-yl)piperazine;dihydrochloride.
What is the SMILES notation for 1-(2,3-dihydro-1H-inden-2-yl)piperazine;dihydrochloride?
The canonical SMILES for 1-(2,3-dihydro-1H-inden-2-yl)piperazine;dihydrochloride is Cl.Cl.c1ccc2c(c1)CC(N1CCNCC1)C2.
What is the InChIKey of 1-(2,3-dihydro-1H-inden-2-yl)piperazine;dihydrochloride?
The InChIKey is CHXVIAWGVGKXPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2.2ClH/c1-2-4-12-10-13(9-11(12)3-1)15-7-5-14-6-8-15;;/h1-4,13-14H,5-10H2;2*1H.
What are the key properties of 1-(2,3-dihydro-1H-inden-2-yl)piperazine;dihydrochloride?
1-(2,3-dihydro-1H-inden-2-yl)piperazine;dihydrochloride has a molecular weight of 275.22 g/mol, XLogP of 1.90, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydro-1H-inden-2-yl)piperazine;dihydrochloride is sourced from PubChem (CID 50944348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).