9-(2,3-dihydro-1H-inden-5-yl)-6,9-diazaspiro[4.5]decane

C17H24N2 — CID 64926161

IUPAC9-(2,3-dihydro-1H-inden-5-yl)-6,9-diazaspiro[4.5]decane
SMILESc1cc2c(cc1N1CCNC3(CCCC3)C1)CCC2
InChIInChI=1S/C17H24N2/c1-2-9-17(8-1)13-19(11-10-18-17)16-7-6-14-4-3-5-15(14)12-16/h6-7,12,18H,1-5,8-11,13H2
InChIKeyQREJMLAJBNHTJL-UHFFFAOYSA-N
MW256.39 g/mol
LogP2.90
Rot. Bonds1

About 9-(2,3-dihydro-1H-inden-5-yl)-6,9-diazaspiro[4.5]decane

9-(2,3-dihydro-1H-inden-5-yl)-6,9-diazaspiro[4.5]decane (PubChem CID 64926161) has the molecular formula C17H24N2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 9-(2,3-dihydro-1H-inden-5-yl)-6,9-diazaspiro[4.5]decane.

Molecular Properties

Compound Name9-(2,3-dihydro-1H-inden-5-yl)-6,9-diazaspiro[4.5]decane
PubChem CID64926161
Molecular FormulaC17H24N2
Molecular Weight256.39 g/mol
Exact Mass256.19
IUPAC Name9-(2,3-dihydro-1H-inden-5-yl)-6,9-diazaspiro[4.5]decane
SMILESc1cc2c(cc1N1CCNC3(CCCC3)C1)CCC2
InChIInChI=1S/C17H24N2/c1-2-9-17(8-1)13-19(11-10-18-17)16-7-6-14-4-3-5-15(14)12-16/h6-7,12,18H,1-5,8-11,13H2
InChIKeyQREJMLAJBNHTJL-UHFFFAOYSA-N
XLogP2.90
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

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Related Compounds

9-naphthalen-2-yl-6,9-diazaspiro[4.5]decane
CID 64952940
9-(4-bromo-3-fluorophenyl)-6,9-diazaspiro[4.5]decane
CID 65429942
4-(4-bromo-3-fluorophenyl)-1,4-diazaspiro[5.5]undecane
CID 65431049
9-[4-methyl-3-(trifluoromethyl)phenyl]-6,9-diazaspiro[4.5]decane
CID 64954522
10-(3-bromo-4-methylphenyl)-6,10-diazaspiro[4.6]undecane
CID 64950005
11-(4-iodophenyl)-7,11-diazaspiro[5.6]dodecane
CID 64943004
10-(3-chlorophenyl)-6,10-diazaspiro[4.6]undecane
CID 64944935
7-phenyl-4,7-diazaspiro[2.5]octane
CID 146100859
4-[3-(methoxymethyl)phenyl]-1,4-diazaspiro[5.5]undecane
CID 64925742
10-(4-fluoro-3-methoxyphenyl)-6,10-diazaspiro[4.6]undecane
CID 114840945
4-(2,4,5-trichlorophenyl)-1,4-diazaspiro[5.5]undecane
CID 64926469
9-(2-bromophenyl)-6,9-diazaspiro[4.5]decane
CID 64925677

Frequently Asked Questions

What is the IUPAC name of 9-(2,3-dihydro-1H-inden-5-yl)-6,9-diazaspiro[4.5]decane?
The IUPAC name of 9-(2,3-dihydro-1H-inden-5-yl)-6,9-diazaspiro[4.5]decane (CID 64926161) is 9-(2,3-dihydro-1H-inden-5-yl)-6,9-diazaspiro[4.5]decane.
What is the SMILES notation for 9-(2,3-dihydro-1H-inden-5-yl)-6,9-diazaspiro[4.5]decane?
The canonical SMILES for 9-(2,3-dihydro-1H-inden-5-yl)-6,9-diazaspiro[4.5]decane is c1cc2c(cc1N1CCNC3(CCCC3)C1)CCC2.
What is the InChIKey of 9-(2,3-dihydro-1H-inden-5-yl)-6,9-diazaspiro[4.5]decane?
The InChIKey is QREJMLAJBNHTJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2/c1-2-9-17(8-1)13-19(11-10-18-17)16-7-6-14-4-3-5-15(14)12-16/h6-7,12,18H,1-5,8-11,13H2.
What are the key properties of 9-(2,3-dihydro-1H-inden-5-yl)-6,9-diazaspiro[4.5]decane?
9-(2,3-dihydro-1H-inden-5-yl)-6,9-diazaspiro[4.5]decane has a molecular weight of 256.39 g/mol, XLogP of 2.90, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(2,3-dihydro-1H-inden-5-yl)-6,9-diazaspiro[4.5]decane is sourced from PubChem (CID 64926161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).