7-aminodispiro[3.0.35.14]nonane-9-carboxylic acid

C10H15NO2 — CID 155822111

IUPAC7-aminodispiro[3.0.35.14]nonane-9-carboxylic acid
SMILESNC1CC2(C1)C(C(=O)O)C21CCC1
InChIInChI=1S/C10H15NO2/c11-6-4-10(5-6)7(8(12)13)9(10)2-1-3-9/h6-7H,1-5,11H2,(H,12,13)
InChIKeyRYZZMAMKHHMNQY-UHFFFAOYSA-N
MW181.23 g/mol
LogP0.98
Rot. Bonds1

About 7-aminodispiro[3.0.35.14]nonane-9-carboxylic acid

7-aminodispiro[3.0.35.14]nonane-9-carboxylic acid (PubChem CID 155822111) has the molecular formula C10H15NO2 and a molecular weight of 181.23 g/mol. Its IUPAC name is 7-aminodispiro[3.0.35.14]nonane-9-carboxylic acid.

Molecular Properties

Compound Name7-aminodispiro[3.0.35.14]nonane-9-carboxylic acid
PubChem CID155822111
Molecular FormulaC10H15NO2
Molecular Weight181.23 g/mol
Exact Mass181.11
IUPAC Name7-aminodispiro[3.0.35.14]nonane-9-carboxylic acid
SMILESNC1CC2(C1)C(C(=O)O)C21CCC1
InChIInChI=1S/C10H15NO2/c11-6-4-10(5-6)7(8(12)13)9(10)2-1-3-9/h6-7H,1-5,11H2,(H,12,13)
InChIKeyRYZZMAMKHHMNQY-UHFFFAOYSA-N
XLogP0.98
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.23
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-aminodispiro[3.0.35.14]nonane-9-carboxylic acid?
The IUPAC name of 7-aminodispiro[3.0.35.14]nonane-9-carboxylic acid (CID 155822111) is 7-aminodispiro[3.0.35.14]nonane-9-carboxylic acid.
What is the SMILES notation for 7-aminodispiro[3.0.35.14]nonane-9-carboxylic acid?
The canonical SMILES for 7-aminodispiro[3.0.35.14]nonane-9-carboxylic acid is NC1CC2(C1)C(C(=O)O)C21CCC1.
What is the InChIKey of 7-aminodispiro[3.0.35.14]nonane-9-carboxylic acid?
The InChIKey is RYZZMAMKHHMNQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2/c11-6-4-10(5-6)7(8(12)13)9(10)2-1-3-9/h6-7H,1-5,11H2,(H,12,13).
What are the key properties of 7-aminodispiro[3.0.35.14]nonane-9-carboxylic acid?
7-aminodispiro[3.0.35.14]nonane-9-carboxylic acid has a molecular weight of 181.23 g/mol, XLogP of 0.98, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-aminodispiro[3.0.35.14]nonane-9-carboxylic acid is sourced from PubChem (CID 155822111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).