9-methyl-5-(2-methylpropyl)-3,9-diazaspiro[5.6]dodecane

C15H30N2 — CID 79320211

IUPAC9-methyl-5-(2-methylpropyl)-3,9-diazaspiro[5.6]dodecane
SMILESCC(C)CC1CNCCC12CCCN(C)CC2
InChIInChI=1S/C15H30N2/c1-13(2)11-14-12-16-8-6-15(14)5-4-9-17(3)10-7-15/h13-14,16H,4-12H2,1-3H3
InChIKeyQZSQBIXEGGJHFO-UHFFFAOYSA-N
MW238.42 g/mol
LogP2.74
Rot. Bonds2

About 9-methyl-5-(2-methylpropyl)-3,9-diazaspiro[5.6]dodecane

9-methyl-5-(2-methylpropyl)-3,9-diazaspiro[5.6]dodecane (PubChem CID 79320211) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is 9-methyl-5-(2-methylpropyl)-3,9-diazaspiro[5.6]dodecane.

Molecular Properties

Compound Name9-methyl-5-(2-methylpropyl)-3,9-diazaspiro[5.6]dodecane
PubChem CID79320211
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name9-methyl-5-(2-methylpropyl)-3,9-diazaspiro[5.6]dodecane
SMILESCC(C)CC1CNCCC12CCCN(C)CC2
InChIInChI=1S/C15H30N2/c1-13(2)11-14-12-16-8-6-15(14)5-4-9-17(3)10-7-15/h13-14,16H,4-12H2,1-3H3
InChIKeyQZSQBIXEGGJHFO-UHFFFAOYSA-N
XLogP2.74
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9-methyl-5-(2-methylpropyl)-3,9-diazaspiro[5.6]dodecane?
The IUPAC name of 9-methyl-5-(2-methylpropyl)-3,9-diazaspiro[5.6]dodecane (CID 79320211) is 9-methyl-5-(2-methylpropyl)-3,9-diazaspiro[5.6]dodecane.
What is the SMILES notation for 9-methyl-5-(2-methylpropyl)-3,9-diazaspiro[5.6]dodecane?
The canonical SMILES for 9-methyl-5-(2-methylpropyl)-3,9-diazaspiro[5.6]dodecane is CC(C)CC1CNCCC12CCCN(C)CC2.
What is the InChIKey of 9-methyl-5-(2-methylpropyl)-3,9-diazaspiro[5.6]dodecane?
The InChIKey is QZSQBIXEGGJHFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-13(2)11-14-12-16-8-6-15(14)5-4-9-17(3)10-7-15/h13-14,16H,4-12H2,1-3H3.
What are the key properties of 9-methyl-5-(2-methylpropyl)-3,9-diazaspiro[5.6]dodecane?
9-methyl-5-(2-methylpropyl)-3,9-diazaspiro[5.6]dodecane has a molecular weight of 238.42 g/mol, XLogP of 2.74, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-5-(2-methylpropyl)-3,9-diazaspiro[5.6]dodecane is sourced from PubChem (CID 79320211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).