N,N-dimethyl-3-azaspiro[5.5]undecan-9-amine

C12H24N2 — CID 58101781

IUPACN,N-dimethyl-3-azaspiro[5.5]undecan-9-amine
SMILESCN(C)C1CCC2(CCNCC2)CC1
InChIInChI=1S/C12H24N2/c1-14(2)11-3-5-12(6-4-11)7-9-13-10-8-12/h11,13H,3-10H2,1-2H3
InChIKeyZBPVTVAWSGTXOL-UHFFFAOYSA-N
MW196.34 g/mol
LogP1.86
Rot. Bonds1

About N,N-dimethyl-3-azaspiro[5.5]undecan-9-amine

N,N-dimethyl-3-azaspiro[5.5]undecan-9-amine (PubChem CID 58101781) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is N,N-dimethyl-3-azaspiro[5.5]undecan-9-amine.

Molecular Properties

Compound NameN,N-dimethyl-3-azaspiro[5.5]undecan-9-amine
PubChem CID58101781
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC NameN,N-dimethyl-3-azaspiro[5.5]undecan-9-amine
SMILESCN(C)C1CCC2(CCNCC2)CC1
InChIInChI=1S/C12H24N2/c1-14(2)11-3-5-12(6-4-11)7-9-13-10-8-12/h11,13H,3-10H2,1-2H3
InChIKeyZBPVTVAWSGTXOL-UHFFFAOYSA-N
XLogP1.86
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3-azaspiro[5.5]undecan-9-amine?
The IUPAC name of N,N-dimethyl-3-azaspiro[5.5]undecan-9-amine (CID 58101781) is N,N-dimethyl-3-azaspiro[5.5]undecan-9-amine.
What is the SMILES notation for N,N-dimethyl-3-azaspiro[5.5]undecan-9-amine?
The canonical SMILES for N,N-dimethyl-3-azaspiro[5.5]undecan-9-amine is CN(C)C1CCC2(CCNCC2)CC1.
What is the InChIKey of N,N-dimethyl-3-azaspiro[5.5]undecan-9-amine?
The InChIKey is ZBPVTVAWSGTXOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-14(2)11-3-5-12(6-4-11)7-9-13-10-8-12/h11,13H,3-10H2,1-2H3.
What are the key properties of N,N-dimethyl-3-azaspiro[5.5]undecan-9-amine?
N,N-dimethyl-3-azaspiro[5.5]undecan-9-amine has a molecular weight of 196.34 g/mol, XLogP of 1.86, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-azaspiro[5.5]undecan-9-amine is sourced from PubChem (CID 58101781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).