1-azaspiro[5.5]undecan-4-amine

C10H20N2 — CID 64981405

IUPAC1-azaspiro[5.5]undecan-4-amine
SMILESNC1CCNC2(CCCCC2)C1
InChIInChI=1S/C10H20N2/c11-9-4-7-12-10(8-9)5-2-1-3-6-10/h9,12H,1-8,11H2
InChIKeyPGAHRUSUFSYTHT-UHFFFAOYSA-N
MW168.28 g/mol
LogP1.40
Rot. Bonds

About 1-azaspiro[5.5]undecan-4-amine

1-azaspiro[5.5]undecan-4-amine (PubChem CID 64981405) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is 1-azaspiro[5.5]undecan-4-amine.

Molecular Properties

Compound Name1-azaspiro[5.5]undecan-4-amine
PubChem CID64981405
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Name1-azaspiro[5.5]undecan-4-amine
SMILESNC1CCNC2(CCCCC2)C1
InChIInChI=1S/C10H20N2/c11-9-4-7-12-10(8-9)5-2-1-3-6-10/h9,12H,1-8,11H2
InChIKeyPGAHRUSUFSYTHT-UHFFFAOYSA-N
XLogP1.40
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-azaspiro[5.5]undecan-4-amine?
The IUPAC name of 1-azaspiro[5.5]undecan-4-amine (CID 64981405) is 1-azaspiro[5.5]undecan-4-amine.
What is the SMILES notation for 1-azaspiro[5.5]undecan-4-amine?
The canonical SMILES for 1-azaspiro[5.5]undecan-4-amine is NC1CCNC2(CCCCC2)C1.
What is the InChIKey of 1-azaspiro[5.5]undecan-4-amine?
The InChIKey is PGAHRUSUFSYTHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2/c11-9-4-7-12-10(8-9)5-2-1-3-6-10/h9,12H,1-8,11H2.
What are the key properties of 1-azaspiro[5.5]undecan-4-amine?
1-azaspiro[5.5]undecan-4-amine has a molecular weight of 168.28 g/mol, XLogP of 1.40, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-azaspiro[5.5]undecan-4-amine is sourced from PubChem (CID 64981405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).