7-[(6-methyl-2-pyridinyl)methyl]-2-pyridin-3-yloxy-7-azaspiro[3.5]nonane

C20H25N3O — CID 97451292

IUPAC7-[(6-methyl-2-pyridinyl)methyl]-2-pyridin-3-yloxy-7-azaspiro[3.5]nonane
SMILESCc1cccc(CN2CCC3(CC2)CC(Oc2cccnc2)C3)n1
InChIInChI=1S/C20H25N3O/c1-16-4-2-5-17(22-16)15-23-10-7-20(8-11-23)12-19(13-20)24-18-6-3-9-21-14-18/h2-6,9,14,19H,7-8,10-13,15H2,1H3
InChIKeyOOASWSDNMYANCO-UHFFFAOYSA-N
MW323.44 g/mol
LogP3.61
Rot. Bonds4

About 7-[(6-methyl-2-pyridinyl)methyl]-2-pyridin-3-yloxy-7-azaspiro[3.5]nonane

7-[(6-methyl-2-pyridinyl)methyl]-2-pyridin-3-yloxy-7-azaspiro[3.5]nonane (PubChem CID 97451292) has the molecular formula C20H25N3O and a molecular weight of 323.44 g/mol. Its IUPAC name is 7-[(6-methyl-2-pyridinyl)methyl]-2-pyridin-3-yloxy-7-azaspiro[3.5]nonane.

Molecular Properties

Compound Name7-[(6-methyl-2-pyridinyl)methyl]-2-pyridin-3-yloxy-7-azaspiro[3.5]nonane
PubChem CID97451292
Molecular FormulaC20H25N3O
Molecular Weight323.44 g/mol
Exact Mass323.20
IUPAC Name7-[(6-methyl-2-pyridinyl)methyl]-2-pyridin-3-yloxy-7-azaspiro[3.5]nonane
SMILESCc1cccc(CN2CCC3(CC2)CC(Oc2cccnc2)C3)n1
InChIInChI=1S/C20H25N3O/c1-16-4-2-5-17(22-16)15-23-10-7-20(8-11-23)12-19(13-20)24-18-6-3-9-21-14-18/h2-6,9,14,19H,7-8,10-13,15H2,1H3
InChIKeyOOASWSDNMYANCO-UHFFFAOYSA-N
XLogP3.61
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.44
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 7-[(6-methyl-2-pyridinyl)methyl]-2-pyridin-3-yloxy-7-azaspiro[3.5]nonane 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 7-[(6-methyl-2-pyridinyl)methyl]-2-pyridin-3-yloxy-7-azaspiro[3.5]nonane?
The IUPAC name of 7-[(6-methyl-2-pyridinyl)methyl]-2-pyridin-3-yloxy-7-azaspiro[3.5]nonane (CID 97451292) is 7-[(6-methyl-2-pyridinyl)methyl]-2-pyridin-3-yloxy-7-azaspiro[3.5]nonane.
What is the SMILES notation for 7-[(6-methyl-2-pyridinyl)methyl]-2-pyridin-3-yloxy-7-azaspiro[3.5]nonane?
The canonical SMILES for 7-[(6-methyl-2-pyridinyl)methyl]-2-pyridin-3-yloxy-7-azaspiro[3.5]nonane is Cc1cccc(CN2CCC3(CC2)CC(Oc2cccnc2)C3)n1.
What is the InChIKey of 7-[(6-methyl-2-pyridinyl)methyl]-2-pyridin-3-yloxy-7-azaspiro[3.5]nonane?
The InChIKey is OOASWSDNMYANCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O/c1-16-4-2-5-17(22-16)15-23-10-7-20(8-11-23)12-19(13-20)24-18-6-3-9-21-14-18/h2-6,9,14,19H,7-8,10-13,15H2,1H3.
What are the key properties of 7-[(6-methyl-2-pyridinyl)methyl]-2-pyridin-3-yloxy-7-azaspiro[3.5]nonane?
7-[(6-methyl-2-pyridinyl)methyl]-2-pyridin-3-yloxy-7-azaspiro[3.5]nonane has a molecular weight of 323.44 g/mol, XLogP of 3.61, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(6-methyl-2-pyridinyl)methyl]-2-pyridin-3-yloxy-7-azaspiro[3.5]nonane is sourced from PubChem (CID 97451292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).