7-tert-butyl-7-azaspiro[3.5]nonan-2-amine

C12H24N2 — CID 121450477

IUPAC7-tert-butyl-7-azaspiro[3.5]nonan-2-amine
SMILESCC(C)(C)N1CCC2(CC1)CC(N)C2
InChIInChI=1S/C12H24N2/c1-11(2,3)14-6-4-12(5-7-14)8-10(13)9-12/h10H,4-9,13H2,1-3H3
InChIKeyWRGFYBBTNJIEJE-UHFFFAOYSA-N
MW196.34 g/mol
LogP1.99
Rot. Bonds

About 7-tert-butyl-7-azaspiro[3.5]nonan-2-amine

7-tert-butyl-7-azaspiro[3.5]nonan-2-amine (PubChem CID 121450477) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is 7-tert-butyl-7-azaspiro[3.5]nonan-2-amine.

Molecular Properties

Compound Name7-tert-butyl-7-azaspiro[3.5]nonan-2-amine
PubChem CID121450477
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name7-tert-butyl-7-azaspiro[3.5]nonan-2-amine
SMILESCC(C)(C)N1CCC2(CC1)CC(N)C2
InChIInChI=1S/C12H24N2/c1-11(2,3)14-6-4-12(5-7-14)8-10(13)9-12/h10H,4-9,13H2,1-3H3
InChIKeyWRGFYBBTNJIEJE-UHFFFAOYSA-N
XLogP1.99
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-tert-butyl-7-azaspiro[3.5]nonan-2-amine?
The IUPAC name of 7-tert-butyl-7-azaspiro[3.5]nonan-2-amine (CID 121450477) is 7-tert-butyl-7-azaspiro[3.5]nonan-2-amine.
What is the SMILES notation for 7-tert-butyl-7-azaspiro[3.5]nonan-2-amine?
The canonical SMILES for 7-tert-butyl-7-azaspiro[3.5]nonan-2-amine is CC(C)(C)N1CCC2(CC1)CC(N)C2.
What is the InChIKey of 7-tert-butyl-7-azaspiro[3.5]nonan-2-amine?
The InChIKey is WRGFYBBTNJIEJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-11(2,3)14-6-4-12(5-7-14)8-10(13)9-12/h10H,4-9,13H2,1-3H3.
What are the key properties of 7-tert-butyl-7-azaspiro[3.5]nonan-2-amine?
7-tert-butyl-7-azaspiro[3.5]nonan-2-amine has a molecular weight of 196.34 g/mol, XLogP of 1.99, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-tert-butyl-7-azaspiro[3.5]nonan-2-amine is sourced from PubChem (CID 121450477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).