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

C9H18N2 — CID 97168977

IUPAC[(5R,8S)-2-azaspiro[4.4]nonan-8-yl]methanamine
SMILESNC[C@H]1CC[C@]2(CCNC2)C1
InChIInChI=1S/C9H18N2/c10-6-8-1-2-9(5-8)3-4-11-7-9/h8,11H,1-7,10H2/t8-,9-/m0/s1
InChIKeyORKFOQZXJBTQKV-IUCAKERBSA-N
MW154.26 g/mol
LogP0.72
Rot. Bonds1

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

[(5R,8S)-2-azaspiro[4.4]nonan-8-yl]methanamine (PubChem CID 97168977) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is [(5R,8S)-2-azaspiro[4.4]nonan-8-yl]methanamine.

Molecular Properties

Compound Name[(5R,8S)-2-azaspiro[4.4]nonan-8-yl]methanamine
PubChem CID97168977
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Name[(5R,8S)-2-azaspiro[4.4]nonan-8-yl]methanamine
SMILESNC[C@H]1CC[C@]2(CCNC2)C1
InChIInChI=1S/C9H18N2/c10-6-8-1-2-9(5-8)3-4-11-7-9/h8,11H,1-7,10H2/t8-,9-/m0/s1
InChIKeyORKFOQZXJBTQKV-IUCAKERBSA-N
XLogP0.72
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 50.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [(5R,8S)-2-azaspiro[4.4]nonan-8-yl]methanamine?
The IUPAC name of [(5R,8S)-2-azaspiro[4.4]nonan-8-yl]methanamine (CID 97168977) is [(5R,8S)-2-azaspiro[4.4]nonan-8-yl]methanamine.
What is the SMILES notation for [(5R,8S)-2-azaspiro[4.4]nonan-8-yl]methanamine?
The canonical SMILES for [(5R,8S)-2-azaspiro[4.4]nonan-8-yl]methanamine is NC[C@H]1CC[C@]2(CCNC2)C1.
What is the InChIKey of [(5R,8S)-2-azaspiro[4.4]nonan-8-yl]methanamine?
The InChIKey is ORKFOQZXJBTQKV-IUCAKERBSA-N. The full InChI is InChI=1S/C9H18N2/c10-6-8-1-2-9(5-8)3-4-11-7-9/h8,11H,1-7,10H2/t8-,9-/m0/s1.
What are the key properties of [(5R,8S)-2-azaspiro[4.4]nonan-8-yl]methanamine?
[(5R,8S)-2-azaspiro[4.4]nonan-8-yl]methanamine has a molecular weight of 154.26 g/mol, XLogP of 0.72, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(5R,8S)-2-azaspiro[4.4]nonan-8-yl]methanamine is sourced from PubChem (CID 97168977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).