2-[(5S,8R)-8-(aminomethyl)-2-azaspiro[4.4]nonan-2-yl]ethanamine

C11H23N3 — CID 97168990

IUPAC2-[(5S,8R)-8-(aminomethyl)-2-azaspiro[4.4]nonan-2-yl]ethanamine
SMILESNCCN1CC[C@@]2(CC[C@@H](CN)C2)C1
InChIInChI=1S/C11H23N3/c12-4-6-14-5-3-11(9-14)2-1-10(7-11)8-13/h10H,1-9,12-13H2/t10-,11-/m1/s1
InChIKeySZDJRKZHNJBZTG-GHMZBOCLSA-N
MW197.33 g/mol
LogP0.40
Rot. Bonds3

About 2-[(5S,8R)-8-(aminomethyl)-2-azaspiro[4.4]nonan-2-yl]ethanamine

2-[(5S,8R)-8-(aminomethyl)-2-azaspiro[4.4]nonan-2-yl]ethanamine (PubChem CID 97168990) has the molecular formula C11H23N3 and a molecular weight of 197.33 g/mol. Its IUPAC name is 2-[(5S,8R)-8-(aminomethyl)-2-azaspiro[4.4]nonan-2-yl]ethanamine.

Molecular Properties

Compound Name2-[(5S,8R)-8-(aminomethyl)-2-azaspiro[4.4]nonan-2-yl]ethanamine
PubChem CID97168990
Molecular FormulaC11H23N3
Molecular Weight197.33 g/mol
Exact Mass197.19
IUPAC Name2-[(5S,8R)-8-(aminomethyl)-2-azaspiro[4.4]nonan-2-yl]ethanamine
SMILESNCCN1CC[C@@]2(CC[C@@H](CN)C2)C1
InChIInChI=1S/C11H23N3/c12-4-6-14-5-3-11(9-14)2-1-10(7-11)8-13/h10H,1-9,12-13H2/t10-,11-/m1/s1
InChIKeySZDJRKZHNJBZTG-GHMZBOCLSA-N
XLogP0.40
TPSA55.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.33
LogP ≤ 50.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(5R,8R)-8-(bromomethyl)-2-azaspiro[4.4]nonan-2-yl]ethanamine
CID 97168987
(5S,8S)-2-(2-aminoethyl)-2-azaspiro[4.4]nonan-8-amine
CID 129426141
[2-(2-chloroethyl)-2-azaspiro[4.5]decan-8-yl]methanamine
CID 71649167
2-[2-(aminomethyl)-6-azaspiro[3.4]octan-6-yl]ethanol
CID 71649151
2-[(5R,8R)-8-(chloromethyl)-2-azaspiro[4.4]nonan-2-yl]ethanol
CID 97169857
2-[(5S,8S)-8-amino-2-azaspiro[4.4]nonan-2-yl]ethanol
CID 98089074
1-[8-(aminomethyl)-2-azaspiro[4.4]nonan-2-yl]ethanone
CID 71628998
(2S)-2-amino-1-[(5R,8R)-8-(aminomethyl)-2-azaspiro[4.4]nonan-2-yl]propan-1-one
CID 98084168
2-(2,7-diazaspiro[4.4]nonan-2-yl)ethanamine
CID 128922534
(5S,8R)-2-ethyl-2-azaspiro[4.4]nonan-8-amine
CID 98084994
2-(2,9-diazaspiro[4.5]decan-2-yl)ethanamine
CID 130608102
(6-cyclopropyl-6-azaspiro[3.4]octan-2-yl)methanamine
CID 71649148

Frequently Asked Questions

What is the IUPAC name of 2-[(5S,8R)-8-(aminomethyl)-2-azaspiro[4.4]nonan-2-yl]ethanamine?
The IUPAC name of 2-[(5S,8R)-8-(aminomethyl)-2-azaspiro[4.4]nonan-2-yl]ethanamine (CID 97168990) is 2-[(5S,8R)-8-(aminomethyl)-2-azaspiro[4.4]nonan-2-yl]ethanamine.
What is the SMILES notation for 2-[(5S,8R)-8-(aminomethyl)-2-azaspiro[4.4]nonan-2-yl]ethanamine?
The canonical SMILES for 2-[(5S,8R)-8-(aminomethyl)-2-azaspiro[4.4]nonan-2-yl]ethanamine is NCCN1CC[C@@]2(CC[C@@H](CN)C2)C1.
What is the InChIKey of 2-[(5S,8R)-8-(aminomethyl)-2-azaspiro[4.4]nonan-2-yl]ethanamine?
The InChIKey is SZDJRKZHNJBZTG-GHMZBOCLSA-N. The full InChI is InChI=1S/C11H23N3/c12-4-6-14-5-3-11(9-14)2-1-10(7-11)8-13/h10H,1-9,12-13H2/t10-,11-/m1/s1.
What are the key properties of 2-[(5S,8R)-8-(aminomethyl)-2-azaspiro[4.4]nonan-2-yl]ethanamine?
2-[(5S,8R)-8-(aminomethyl)-2-azaspiro[4.4]nonan-2-yl]ethanamine has a molecular weight of 197.33 g/mol, XLogP of 0.40, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5S,8R)-8-(aminomethyl)-2-azaspiro[4.4]nonan-2-yl]ethanamine is sourced from PubChem (CID 97168990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).