9-(2-methyl-2,7-diazaspiro[4.5]decan-7-yl)-3-azaspiro[5.5]undecane

C19H35N3 — CID 56739556

IUPAC9-(2-methyl-2,7-diazaspiro[4.5]decan-7-yl)-3-azaspiro[5.5]undecane
SMILESCN1CCC2(CCCN(C3CCC4(CCNCC4)CC3)C2)C1
InChIInChI=1S/C19H35N3/c1-21-14-10-19(15-21)5-2-13-22(16-19)17-3-6-18(7-4-17)8-11-20-12-9-18/h17,20H,2-16H2,1H3
InChIKeyNMJZPIGGSODBMN-UHFFFAOYSA-N
MW305.51 g/mol
LogP2.72
Rot. Bonds1

About 9-(2-methyl-2,7-diazaspiro[4.5]decan-7-yl)-3-azaspiro[5.5]undecane

9-(2-methyl-2,7-diazaspiro[4.5]decan-7-yl)-3-azaspiro[5.5]undecane (PubChem CID 56739556) has the molecular formula C19H35N3 and a molecular weight of 305.51 g/mol. Its IUPAC name is 9-(2-methyl-2,7-diazaspiro[4.5]decan-7-yl)-3-azaspiro[5.5]undecane.

Molecular Properties

Compound Name9-(2-methyl-2,7-diazaspiro[4.5]decan-7-yl)-3-azaspiro[5.5]undecane
PubChem CID56739556
Molecular FormulaC19H35N3
Molecular Weight305.51 g/mol
Exact Mass305.28
IUPAC Name9-(2-methyl-2,7-diazaspiro[4.5]decan-7-yl)-3-azaspiro[5.5]undecane
SMILESCN1CCC2(CCCN(C3CCC4(CCNCC4)CC3)C2)C1
InChIInChI=1S/C19H35N3/c1-21-14-10-19(15-21)5-2-13-22(16-19)17-3-6-18(7-4-17)8-11-20-12-9-18/h17,20H,2-16H2,1H3
InChIKeyNMJZPIGGSODBMN-UHFFFAOYSA-N
XLogP2.72
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.51
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 9-(2-methyl-2,7-diazaspiro[4.5]decan-7-yl)-3-azaspiro[5.5]undecane?
The IUPAC name of 9-(2-methyl-2,7-diazaspiro[4.5]decan-7-yl)-3-azaspiro[5.5]undecane (CID 56739556) is 9-(2-methyl-2,7-diazaspiro[4.5]decan-7-yl)-3-azaspiro[5.5]undecane.
What is the SMILES notation for 9-(2-methyl-2,7-diazaspiro[4.5]decan-7-yl)-3-azaspiro[5.5]undecane?
The canonical SMILES for 9-(2-methyl-2,7-diazaspiro[4.5]decan-7-yl)-3-azaspiro[5.5]undecane is CN1CCC2(CCCN(C3CCC4(CCNCC4)CC3)C2)C1.
What is the InChIKey of 9-(2-methyl-2,7-diazaspiro[4.5]decan-7-yl)-3-azaspiro[5.5]undecane?
The InChIKey is NMJZPIGGSODBMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H35N3/c1-21-14-10-19(15-21)5-2-13-22(16-19)17-3-6-18(7-4-17)8-11-20-12-9-18/h17,20H,2-16H2,1H3.
What are the key properties of 9-(2-methyl-2,7-diazaspiro[4.5]decan-7-yl)-3-azaspiro[5.5]undecane?
9-(2-methyl-2,7-diazaspiro[4.5]decan-7-yl)-3-azaspiro[5.5]undecane has a molecular weight of 305.51 g/mol, XLogP of 2.72, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(2-methyl-2,7-diazaspiro[4.5]decan-7-yl)-3-azaspiro[5.5]undecane is sourced from PubChem (CID 56739556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).