8-aminospiro[3.5]nonane-8-carboxylic acid;hydrochloride

C10H18ClNO2 — CID 139026831

IUPAC8-aminospiro[3.5]nonane-8-carboxylic acid;hydrochloride
SMILESCl.NC1(C(=O)O)CCCC2(CCC2)C1
InChIInChI=1S/C10H17NO2.ClH/c11-10(8(12)13)6-2-5-9(7-10)3-1-4-9;/h1-7,11H2,(H,12,13);1H
InChIKeyBFAYIZJCTVLILE-UHFFFAOYSA-N
MW219.71 g/mol
LogP1.93
Rot. Bonds1

About 8-aminospiro[3.5]nonane-8-carboxylic acid;hydrochloride

8-aminospiro[3.5]nonane-8-carboxylic acid;hydrochloride (PubChem CID 139026831) has the molecular formula C10H18ClNO2 and a molecular weight of 219.71 g/mol. Its IUPAC name is 8-aminospiro[3.5]nonane-8-carboxylic acid;hydrochloride.

Molecular Properties

Compound Name8-aminospiro[3.5]nonane-8-carboxylic acid;hydrochloride
PubChem CID139026831
Molecular FormulaC10H18ClNO2
Molecular Weight219.71 g/mol
Exact Mass219.10
IUPAC Name8-aminospiro[3.5]nonane-8-carboxylic acid;hydrochloride
SMILESCl.NC1(C(=O)O)CCCC2(CCC2)C1
InChIInChI=1S/C10H17NO2.ClH/c11-10(8(12)13)6-2-5-9(7-10)3-1-4-9;/h1-7,11H2,(H,12,13);1H
InChIKeyBFAYIZJCTVLILE-UHFFFAOYSA-N
XLogP1.93
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.71
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-aminospiro[3.5]nonane-8-carboxylic acid;hydrochloride?
The IUPAC name of 8-aminospiro[3.5]nonane-8-carboxylic acid;hydrochloride (CID 139026831) is 8-aminospiro[3.5]nonane-8-carboxylic acid;hydrochloride.
What is the SMILES notation for 8-aminospiro[3.5]nonane-8-carboxylic acid;hydrochloride?
The canonical SMILES for 8-aminospiro[3.5]nonane-8-carboxylic acid;hydrochloride is Cl.NC1(C(=O)O)CCCC2(CCC2)C1.
What is the InChIKey of 8-aminospiro[3.5]nonane-8-carboxylic acid;hydrochloride?
The InChIKey is BFAYIZJCTVLILE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2.ClH/c11-10(8(12)13)6-2-5-9(7-10)3-1-4-9;/h1-7,11H2,(H,12,13);1H.
What are the key properties of 8-aminospiro[3.5]nonane-8-carboxylic acid;hydrochloride?
8-aminospiro[3.5]nonane-8-carboxylic acid;hydrochloride has a molecular weight of 219.71 g/mol, XLogP of 1.93, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-aminospiro[3.5]nonane-8-carboxylic acid;hydrochloride is sourced from PubChem (CID 139026831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).