1-(2-azaspiro[3.3]heptan-2-yl)propan-2-amine

C9H18N2 — CID 79678743

IUPAC1-(2-azaspiro[3.3]heptan-2-yl)propan-2-amine
SMILESCC(N)CN1CC2(CCC2)C1
InChIInChI=1S/C9H18N2/c1-8(10)5-11-6-9(7-11)3-2-4-9/h8H,2-7,10H2,1H3
InChIKeyADYYQGUZKGYDFT-UHFFFAOYSA-N
MW154.26 g/mol
LogP0.82
Rot. Bonds2

About 1-(2-azaspiro[3.3]heptan-2-yl)propan-2-amine

1-(2-azaspiro[3.3]heptan-2-yl)propan-2-amine (PubChem CID 79678743) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is 1-(2-azaspiro[3.3]heptan-2-yl)propan-2-amine.

Molecular Properties

Compound Name1-(2-azaspiro[3.3]heptan-2-yl)propan-2-amine
PubChem CID79678743
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Name1-(2-azaspiro[3.3]heptan-2-yl)propan-2-amine
SMILESCC(N)CN1CC2(CCC2)C1
InChIInChI=1S/C9H18N2/c1-8(10)5-11-6-9(7-11)3-2-4-9/h8H,2-7,10H2,1H3
InChIKeyADYYQGUZKGYDFT-UHFFFAOYSA-N
XLogP0.82
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-azaspiro[3.3]heptan-2-yl)propan-2-amine?
The IUPAC name of 1-(2-azaspiro[3.3]heptan-2-yl)propan-2-amine (CID 79678743) is 1-(2-azaspiro[3.3]heptan-2-yl)propan-2-amine.
What is the SMILES notation for 1-(2-azaspiro[3.3]heptan-2-yl)propan-2-amine?
The canonical SMILES for 1-(2-azaspiro[3.3]heptan-2-yl)propan-2-amine is CC(N)CN1CC2(CCC2)C1.
What is the InChIKey of 1-(2-azaspiro[3.3]heptan-2-yl)propan-2-amine?
The InChIKey is ADYYQGUZKGYDFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2/c1-8(10)5-11-6-9(7-11)3-2-4-9/h8H,2-7,10H2,1H3.
What are the key properties of 1-(2-azaspiro[3.3]heptan-2-yl)propan-2-amine?
1-(2-azaspiro[3.3]heptan-2-yl)propan-2-amine has a molecular weight of 154.26 g/mol, XLogP of 0.82, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-azaspiro[3.3]heptan-2-yl)propan-2-amine is sourced from PubChem (CID 79678743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).