6-(quinolin-2-ylmethyl)-6,9-diazaspiro[4.5]decane

C18H23N3 — CID 64845221

IUPAC6-(quinolin-2-ylmethyl)-6,9-diazaspiro[4.5]decane
SMILESc1ccc2nc(CN3CCNCC34CCCC4)ccc2c1
InChIInChI=1S/C18H23N3/c1-2-6-17-15(5-1)7-8-16(20-17)13-21-12-11-19-14-18(21)9-3-4-10-18/h1-2,5-8,19H,3-4,9-14H2
InChIKeyVSPPDVKFUIRKKT-UHFFFAOYSA-N
MW281.40 g/mol
LogP2.95
Rot. Bonds2

About 6-(quinolin-2-ylmethyl)-6,9-diazaspiro[4.5]decane

6-(quinolin-2-ylmethyl)-6,9-diazaspiro[4.5]decane (PubChem CID 64845221) has the molecular formula C18H23N3 and a molecular weight of 281.40 g/mol. Its IUPAC name is 6-(quinolin-2-ylmethyl)-6,9-diazaspiro[4.5]decane.

Molecular Properties

Compound Name6-(quinolin-2-ylmethyl)-6,9-diazaspiro[4.5]decane
PubChem CID64845221
Molecular FormulaC18H23N3
Molecular Weight281.40 g/mol
Exact Mass281.19
IUPAC Name6-(quinolin-2-ylmethyl)-6,9-diazaspiro[4.5]decane
SMILESc1ccc2nc(CN3CCNCC34CCCC4)ccc2c1
InChIInChI=1S/C18H23N3/c1-2-6-17-15(5-1)7-8-16(20-17)13-21-12-11-19-14-18(21)9-3-4-10-18/h1-2,5-8,19H,3-4,9-14H2
InChIKeyVSPPDVKFUIRKKT-UHFFFAOYSA-N
XLogP2.95
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-(quinolin-2-ylmethyl)-6,9-diazaspiro[4.5]decane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-(quinolin-2-ylmethyl)-6,9-diazaspiro[4.5]decane?
The IUPAC name of 6-(quinolin-2-ylmethyl)-6,9-diazaspiro[4.5]decane (CID 64845221) is 6-(quinolin-2-ylmethyl)-6,9-diazaspiro[4.5]decane.
What is the SMILES notation for 6-(quinolin-2-ylmethyl)-6,9-diazaspiro[4.5]decane?
The canonical SMILES for 6-(quinolin-2-ylmethyl)-6,9-diazaspiro[4.5]decane is c1ccc2nc(CN3CCNCC34CCCC4)ccc2c1.
What is the InChIKey of 6-(quinolin-2-ylmethyl)-6,9-diazaspiro[4.5]decane?
The InChIKey is VSPPDVKFUIRKKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3/c1-2-6-17-15(5-1)7-8-16(20-17)13-21-12-11-19-14-18(21)9-3-4-10-18/h1-2,5-8,19H,3-4,9-14H2.
What are the key properties of 6-(quinolin-2-ylmethyl)-6,9-diazaspiro[4.5]decane?
6-(quinolin-2-ylmethyl)-6,9-diazaspiro[4.5]decane has a molecular weight of 281.40 g/mol, XLogP of 2.95, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(quinolin-2-ylmethyl)-6,9-diazaspiro[4.5]decane is sourced from PubChem (CID 64845221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).