7-methyl-2-[2-(1-methylpiperidin-3-yl)-2-azaspiro[3.5]nonan-7-yl]-2-azaspiro[3.5]nonane

C23H41N3 — CID 166934550

IUPAC7-methyl-2-[2-(1-methylpiperidin-3-yl)-2-azaspiro[3.5]nonan-7-yl]-2-azaspiro[3.5]nonane
SMILESCC1CCC2(CC1)CN(C1CCC3(CC1)CN(C1CCCN(C)C1)C3)C2
InChIInChI=1S/C23H41N3/c1-19-5-9-22(10-6-19)15-25(16-22)20-7-11-23(12-8-20)17-26(18-23)21-4-3-13-24(2)14-21/h19-21H,3-18H2,1-2H3
InChIKeyZRYWPABCIACKED-UHFFFAOYSA-N
MW359.60 g/mol
LogP3.84
Rot. Bonds2

About 7-methyl-2-[2-(1-methylpiperidin-3-yl)-2-azaspiro[3.5]nonan-7-yl]-2-azaspiro[3.5]nonane

7-methyl-2-[2-(1-methylpiperidin-3-yl)-2-azaspiro[3.5]nonan-7-yl]-2-azaspiro[3.5]nonane (PubChem CID 166934550) has the molecular formula C23H41N3 and a molecular weight of 359.60 g/mol. Its IUPAC name is 7-methyl-2-[2-(1-methylpiperidin-3-yl)-2-azaspiro[3.5]nonan-7-yl]-2-azaspiro[3.5]nonane.

Molecular Properties

Compound Name7-methyl-2-[2-(1-methylpiperidin-3-yl)-2-azaspiro[3.5]nonan-7-yl]-2-azaspiro[3.5]nonane
PubChem CID166934550
Molecular FormulaC23H41N3
Molecular Weight359.60 g/mol
Exact Mass359.33
IUPAC Name7-methyl-2-[2-(1-methylpiperidin-3-yl)-2-azaspiro[3.5]nonan-7-yl]-2-azaspiro[3.5]nonane
SMILESCC1CCC2(CC1)CN(C1CCC3(CC1)CN(C1CCCN(C)C1)C3)C2
InChIInChI=1S/C23H41N3/c1-19-5-9-22(10-6-19)15-25(16-22)20-7-11-23(12-8-20)17-26(18-23)21-4-3-13-24(2)14-21/h19-21H,3-18H2,1-2H3
InChIKeyZRYWPABCIACKED-UHFFFAOYSA-N
XLogP3.84
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.60
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-2-[2-(1-methylpiperidin-3-yl)-2-azaspiro[3.5]nonan-7-yl]-2-azaspiro[3.5]nonane?
The IUPAC name of 7-methyl-2-[2-(1-methylpiperidin-3-yl)-2-azaspiro[3.5]nonan-7-yl]-2-azaspiro[3.5]nonane (CID 166934550) is 7-methyl-2-[2-(1-methylpiperidin-3-yl)-2-azaspiro[3.5]nonan-7-yl]-2-azaspiro[3.5]nonane.
What is the SMILES notation for 7-methyl-2-[2-(1-methylpiperidin-3-yl)-2-azaspiro[3.5]nonan-7-yl]-2-azaspiro[3.5]nonane?
The canonical SMILES for 7-methyl-2-[2-(1-methylpiperidin-3-yl)-2-azaspiro[3.5]nonan-7-yl]-2-azaspiro[3.5]nonane is CC1CCC2(CC1)CN(C1CCC3(CC1)CN(C1CCCN(C)C1)C3)C2.
What is the InChIKey of 7-methyl-2-[2-(1-methylpiperidin-3-yl)-2-azaspiro[3.5]nonan-7-yl]-2-azaspiro[3.5]nonane?
The InChIKey is ZRYWPABCIACKED-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H41N3/c1-19-5-9-22(10-6-19)15-25(16-22)20-7-11-23(12-8-20)17-26(18-23)21-4-3-13-24(2)14-21/h19-21H,3-18H2,1-2H3.
What are the key properties of 7-methyl-2-[2-(1-methylpiperidin-3-yl)-2-azaspiro[3.5]nonan-7-yl]-2-azaspiro[3.5]nonane?
7-methyl-2-[2-(1-methylpiperidin-3-yl)-2-azaspiro[3.5]nonan-7-yl]-2-azaspiro[3.5]nonane has a molecular weight of 359.60 g/mol, XLogP of 3.84, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-2-[2-(1-methylpiperidin-3-yl)-2-azaspiro[3.5]nonan-7-yl]-2-azaspiro[3.5]nonane is sourced from PubChem (CID 166934550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).