7-[(6-methyl-2H-pyridin-1-yl)methyl]-6-azaspiro[2.5]octane

C14H22N2 — CID 141285219

IUPAC7-[(6-methyl-2H-pyridin-1-yl)methyl]-6-azaspiro[2.5]octane
SMILESCC1=CC=CCN1CC1CC2(CCN1)CC2
InChIInChI=1S/C14H22N2/c1-12-4-2-3-9-16(12)11-13-10-14(5-6-14)7-8-15-13/h2-4,13,15H,5-11H2,1H3
InChIKeyASKUYVCWOXWHKH-UHFFFAOYSA-N
MW218.34 g/mol
LogP2.29
Rot. Bonds2

About 7-[(6-methyl-2H-pyridin-1-yl)methyl]-6-azaspiro[2.5]octane

7-[(6-methyl-2H-pyridin-1-yl)methyl]-6-azaspiro[2.5]octane (PubChem CID 141285219) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is 7-[(6-methyl-2H-pyridin-1-yl)methyl]-6-azaspiro[2.5]octane.

Molecular Properties

Compound Name7-[(6-methyl-2H-pyridin-1-yl)methyl]-6-azaspiro[2.5]octane
PubChem CID141285219
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC Name7-[(6-methyl-2H-pyridin-1-yl)methyl]-6-azaspiro[2.5]octane
SMILESCC1=CC=CCN1CC1CC2(CCN1)CC2
InChIInChI=1S/C14H22N2/c1-12-4-2-3-9-16(12)11-13-10-14(5-6-14)7-8-15-13/h2-4,13,15H,5-11H2,1H3
InChIKeyASKUYVCWOXWHKH-UHFFFAOYSA-N
XLogP2.29
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-[(6-methyl-2H-pyridin-1-yl)methyl]-6-azaspiro[2.5]octane?
The IUPAC name of 7-[(6-methyl-2H-pyridin-1-yl)methyl]-6-azaspiro[2.5]octane (CID 141285219) is 7-[(6-methyl-2H-pyridin-1-yl)methyl]-6-azaspiro[2.5]octane.
What is the SMILES notation for 7-[(6-methyl-2H-pyridin-1-yl)methyl]-6-azaspiro[2.5]octane?
The canonical SMILES for 7-[(6-methyl-2H-pyridin-1-yl)methyl]-6-azaspiro[2.5]octane is CC1=CC=CCN1CC1CC2(CCN1)CC2.
What is the InChIKey of 7-[(6-methyl-2H-pyridin-1-yl)methyl]-6-azaspiro[2.5]octane?
The InChIKey is ASKUYVCWOXWHKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-12-4-2-3-9-16(12)11-13-10-14(5-6-14)7-8-15-13/h2-4,13,15H,5-11H2,1H3.
What are the key properties of 7-[(6-methyl-2H-pyridin-1-yl)methyl]-6-azaspiro[2.5]octane?
7-[(6-methyl-2H-pyridin-1-yl)methyl]-6-azaspiro[2.5]octane has a molecular weight of 218.34 g/mol, XLogP of 2.29, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(6-methyl-2H-pyridin-1-yl)methyl]-6-azaspiro[2.5]octane is sourced from PubChem (CID 141285219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).