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

C13H18N2 — CID 22648168

IUPAC1-(2,3-dihydro-1H-inden-2-yl)piperazine
SMILESc1ccc2c(c1)CC(N1CCNCC1)C2
InChIInChI=1S/C13H18N2/c1-2-4-12-10-13(9-11(12)3-1)15-7-5-14-6-8-15/h1-4,13-14H,5-10H2
InChIKeyKZTQJRQEVNIIDS-UHFFFAOYSA-N
MW202.30 g/mol
LogP1.06
Rot. Bonds1

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

1-(2,3-dihydro-1H-inden-2-yl)piperazine (PubChem CID 22648168) has the molecular formula C13H18N2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 1-(2,3-dihydro-1H-inden-2-yl)piperazine.

Molecular Properties

Compound Name1-(2,3-dihydro-1H-inden-2-yl)piperazine
PubChem CID22648168
Molecular FormulaC13H18N2
Molecular Weight202.30 g/mol
Exact Mass202.15
IUPAC Name1-(2,3-dihydro-1H-inden-2-yl)piperazine
SMILESc1ccc2c(c1)CC(N1CCNCC1)C2
InChIInChI=1S/C13H18N2/c1-2-4-12-10-13(9-11(12)3-1)15-7-5-14-6-8-15/h1-4,13-14H,5-10H2
InChIKeyKZTQJRQEVNIIDS-UHFFFAOYSA-N
XLogP1.06
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1H-inden-2-yl)piperazine?
The IUPAC name of 1-(2,3-dihydro-1H-inden-2-yl)piperazine (CID 22648168) is 1-(2,3-dihydro-1H-inden-2-yl)piperazine.
What is the SMILES notation for 1-(2,3-dihydro-1H-inden-2-yl)piperazine?
The canonical SMILES for 1-(2,3-dihydro-1H-inden-2-yl)piperazine is c1ccc2c(c1)CC(N1CCNCC1)C2.
What is the InChIKey of 1-(2,3-dihydro-1H-inden-2-yl)piperazine?
The InChIKey is KZTQJRQEVNIIDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2/c1-2-4-12-10-13(9-11(12)3-1)15-7-5-14-6-8-15/h1-4,13-14H,5-10H2.
What are the key properties of 1-(2,3-dihydro-1H-inden-2-yl)piperazine?
1-(2,3-dihydro-1H-inden-2-yl)piperazine has a molecular weight of 202.30 g/mol, XLogP of 1.06, 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 is sourced from PubChem (CID 22648168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).