2-methyl-2,9-diazaspiro[4.5]decane;dihydrochloride

C9H20Cl2N2 — CID 71743834

IUPAC2-methyl-2,9-diazaspiro[4.5]decane;dihydrochloride
SMILESCN1CCC2(CCCNC2)C1.Cl.Cl
InChIInChI=1S/C9H18N2.2ClH/c1-11-6-4-9(8-11)3-2-5-10-7-9;;/h10H,2-8H2,1H3;2*1H
InChIKeyJTCVGDHJMNBCEH-UHFFFAOYSA-N
MW227.18 g/mol
LogP1.54
Rot. Bonds

About 2-methyl-2,9-diazaspiro[4.5]decane;dihydrochloride

2-methyl-2,9-diazaspiro[4.5]decane;dihydrochloride (PubChem CID 71743834) has the molecular formula C9H20Cl2N2 and a molecular weight of 227.18 g/mol. Its IUPAC name is 2-methyl-2,9-diazaspiro[4.5]decane;dihydrochloride.

Molecular Properties

Compound Name2-methyl-2,9-diazaspiro[4.5]decane;dihydrochloride
PubChem CID71743834
Molecular FormulaC9H20Cl2N2
Molecular Weight227.18 g/mol
Exact Mass226.10
IUPAC Name2-methyl-2,9-diazaspiro[4.5]decane;dihydrochloride
SMILESCN1CCC2(CCCNC2)C1.Cl.Cl
InChIInChI=1S/C9H18N2.2ClH/c1-11-6-4-9(8-11)3-2-5-10-7-9;;/h10H,2-8H2,1H3;2*1H
InChIKeyJTCVGDHJMNBCEH-UHFFFAOYSA-N
XLogP1.54
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.18
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2,9-diazaspiro[4.5]decane;dihydrochloride?
The IUPAC name of 2-methyl-2,9-diazaspiro[4.5]decane;dihydrochloride (CID 71743834) is 2-methyl-2,9-diazaspiro[4.5]decane;dihydrochloride.
What is the SMILES notation for 2-methyl-2,9-diazaspiro[4.5]decane;dihydrochloride?
The canonical SMILES for 2-methyl-2,9-diazaspiro[4.5]decane;dihydrochloride is CN1CCC2(CCCNC2)C1.Cl.Cl.
What is the InChIKey of 2-methyl-2,9-diazaspiro[4.5]decane;dihydrochloride?
The InChIKey is JTCVGDHJMNBCEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2.2ClH/c1-11-6-4-9(8-11)3-2-5-10-7-9;;/h10H,2-8H2,1H3;2*1H.
What are the key properties of 2-methyl-2,9-diazaspiro[4.5]decane;dihydrochloride?
2-methyl-2,9-diazaspiro[4.5]decane;dihydrochloride has a molecular weight of 227.18 g/mol, XLogP of 1.54, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2,9-diazaspiro[4.5]decane;dihydrochloride is sourced from PubChem (CID 71743834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).