2,8-diazaspiro[4.5]dec-1-en-1-amine;hydrochloride

C8H16ClN3 — CID 135185643

IUPAC2,8-diazaspiro[4.5]dec-1-en-1-amine;hydrochloride
SMILESCl.NC1=NCCC12CCNCC2
InChIInChI=1S/C8H15N3.ClH/c9-7-8(3-6-11-7)1-4-10-5-2-8;/h10H,1-6H2,(H2,9,11);1H
InChIKeyLSKKDPPKXIVEDM-UHFFFAOYSA-N
MW189.69 g/mol
LogP0.54
Rot. Bonds

About 2,8-diazaspiro[4.5]dec-1-en-1-amine;hydrochloride

2,8-diazaspiro[4.5]dec-1-en-1-amine;hydrochloride (PubChem CID 135185643) has the molecular formula C8H16ClN3 and a molecular weight of 189.69 g/mol. Its IUPAC name is 2,8-diazaspiro[4.5]dec-1-en-1-amine;hydrochloride.

Molecular Properties

Compound Name2,8-diazaspiro[4.5]dec-1-en-1-amine;hydrochloride
PubChem CID135185643
Molecular FormulaC8H16ClN3
Molecular Weight189.69 g/mol
Exact Mass189.10
IUPAC Name2,8-diazaspiro[4.5]dec-1-en-1-amine;hydrochloride
SMILESCl.NC1=NCCC12CCNCC2
InChIInChI=1S/C8H15N3.ClH/c9-7-8(3-6-11-7)1-4-10-5-2-8;/h10H,1-6H2,(H2,9,11);1H
InChIKeyLSKKDPPKXIVEDM-UHFFFAOYSA-N
XLogP0.54
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.69
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,8-diazaspiro[4.5]dec-1-en-1-amine;hydrochloride?
The IUPAC name of 2,8-diazaspiro[4.5]dec-1-en-1-amine;hydrochloride (CID 135185643) is 2,8-diazaspiro[4.5]dec-1-en-1-amine;hydrochloride.
What is the SMILES notation for 2,8-diazaspiro[4.5]dec-1-en-1-amine;hydrochloride?
The canonical SMILES for 2,8-diazaspiro[4.5]dec-1-en-1-amine;hydrochloride is Cl.NC1=NCCC12CCNCC2.
What is the InChIKey of 2,8-diazaspiro[4.5]dec-1-en-1-amine;hydrochloride?
The InChIKey is LSKKDPPKXIVEDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3.ClH/c9-7-8(3-6-11-7)1-4-10-5-2-8;/h10H,1-6H2,(H2,9,11);1H.
What are the key properties of 2,8-diazaspiro[4.5]dec-1-en-1-amine;hydrochloride?
2,8-diazaspiro[4.5]dec-1-en-1-amine;hydrochloride has a molecular weight of 189.69 g/mol, XLogP of 0.54, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,8-diazaspiro[4.5]dec-1-en-1-amine;hydrochloride is sourced from PubChem (CID 135185643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).