2-cyclopropyl-1-(2,3-dihydro-1H-inden-5-ylmethyl)piperazine

C17H24N2 — CID 64833751

IUPAC2-cyclopropyl-1-(2,3-dihydro-1H-inden-5-ylmethyl)piperazine
SMILESc1cc2c(cc1CN1CCNCC1C1CC1)CCC2
InChIInChI=1S/C17H24N2/c1-2-14-5-4-13(10-16(14)3-1)12-19-9-8-18-11-17(19)15-6-7-15/h4-5,10,15,17-18H,1-3,6-9,11-12H2
InChIKeyQMIHWUIYIXQVOP-UHFFFAOYSA-N
MW256.39 g/mol
LogP2.36
Rot. Bonds3

About 2-cyclopropyl-1-(2,3-dihydro-1H-inden-5-ylmethyl)piperazine

2-cyclopropyl-1-(2,3-dihydro-1H-inden-5-ylmethyl)piperazine (PubChem CID 64833751) has the molecular formula C17H24N2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 2-cyclopropyl-1-(2,3-dihydro-1H-inden-5-ylmethyl)piperazine.

Molecular Properties

Compound Name2-cyclopropyl-1-(2,3-dihydro-1H-inden-5-ylmethyl)piperazine
PubChem CID64833751
Molecular FormulaC17H24N2
Molecular Weight256.39 g/mol
Exact Mass256.19
IUPAC Name2-cyclopropyl-1-(2,3-dihydro-1H-inden-5-ylmethyl)piperazine
SMILESc1cc2c(cc1CN1CCNCC1C1CC1)CCC2
InChIInChI=1S/C17H24N2/c1-2-14-5-4-13(10-16(14)3-1)12-19-9-8-18-11-17(19)15-6-7-15/h4-5,10,15,17-18H,1-3,6-9,11-12H2
InChIKeyQMIHWUIYIXQVOP-UHFFFAOYSA-N
XLogP2.36
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-(2,3-dihydro-1H-inden-5-ylmethyl)piperazine?
The IUPAC name of 2-cyclopropyl-1-(2,3-dihydro-1H-inden-5-ylmethyl)piperazine (CID 64833751) is 2-cyclopropyl-1-(2,3-dihydro-1H-inden-5-ylmethyl)piperazine.
What is the SMILES notation for 2-cyclopropyl-1-(2,3-dihydro-1H-inden-5-ylmethyl)piperazine?
The canonical SMILES for 2-cyclopropyl-1-(2,3-dihydro-1H-inden-5-ylmethyl)piperazine is c1cc2c(cc1CN1CCNCC1C1CC1)CCC2.
What is the InChIKey of 2-cyclopropyl-1-(2,3-dihydro-1H-inden-5-ylmethyl)piperazine?
The InChIKey is QMIHWUIYIXQVOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2/c1-2-14-5-4-13(10-16(14)3-1)12-19-9-8-18-11-17(19)15-6-7-15/h4-5,10,15,17-18H,1-3,6-9,11-12H2.
What are the key properties of 2-cyclopropyl-1-(2,3-dihydro-1H-inden-5-ylmethyl)piperazine?
2-cyclopropyl-1-(2,3-dihydro-1H-inden-5-ylmethyl)piperazine has a molecular weight of 256.39 g/mol, XLogP of 2.36, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-(2,3-dihydro-1H-inden-5-ylmethyl)piperazine is sourced from PubChem (CID 64833751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).