6-benzyl-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane

C19H30N2 — CID 64848189

IUPAC6-benzyl-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane
SMILESCC(C)CC1CN(Cc2ccccc2)C2(CCCC2)CN1
InChIInChI=1S/C19H30N2/c1-16(2)12-18-14-21(13-17-8-4-3-5-9-17)19(15-20-18)10-6-7-11-19/h3-5,8-9,16,18,20H,6-7,10-15H2,1-2H3
InChIKeyFKQJIPWIGXVLGN-UHFFFAOYSA-N
MW286.46 g/mol
LogP3.82
Rot. Bonds4

About 6-benzyl-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane

6-benzyl-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane (PubChem CID 64848189) has the molecular formula C19H30N2 and a molecular weight of 286.46 g/mol. Its IUPAC name is 6-benzyl-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane.

Molecular Properties

Compound Name6-benzyl-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane
PubChem CID64848189
Molecular FormulaC19H30N2
Molecular Weight286.46 g/mol
Exact Mass286.24
IUPAC Name6-benzyl-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane
SMILESCC(C)CC1CN(Cc2ccccc2)C2(CCCC2)CN1
InChIInChI=1S/C19H30N2/c1-16(2)12-18-14-21(13-17-8-4-3-5-9-17)19(15-20-18)10-6-7-11-19/h3-5,8-9,16,18,20H,6-7,10-15H2,1-2H3
InChIKeyFKQJIPWIGXVLGN-UHFFFAOYSA-N
XLogP3.82
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.46
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-benzyl-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane?
The IUPAC name of 6-benzyl-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane (CID 64848189) is 6-benzyl-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane.
What is the SMILES notation for 6-benzyl-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane?
The canonical SMILES for 6-benzyl-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane is CC(C)CC1CN(Cc2ccccc2)C2(CCCC2)CN1.
What is the InChIKey of 6-benzyl-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane?
The InChIKey is FKQJIPWIGXVLGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2/c1-16(2)12-18-14-21(13-17-8-4-3-5-9-17)19(15-20-18)10-6-7-11-19/h3-5,8-9,16,18,20H,6-7,10-15H2,1-2H3.
What are the key properties of 6-benzyl-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane?
6-benzyl-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane has a molecular weight of 286.46 g/mol, XLogP of 3.82, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-benzyl-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane is sourced from PubChem (CID 64848189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).