3,3-dimethyl-7-(5-methyl-2-pyridinyl)-7-azaspiro[3.5]nonane;ethane

C18H30N2 — CID 144539338

IUPAC3,3-dimethyl-7-(5-methyl-2-pyridinyl)-7-azaspiro[3.5]nonane;ethane
SMILESCC.Cc1ccc(N2CCC3(CC2)CCC3(C)C)nc1
InChIInChI=1S/C16H24N2.C2H6/c1-13-4-5-14(17-12-13)18-10-8-16(9-11-18)7-6-15(16,2)3;1-2/h4-5,12H,6-11H2,1-3H3;1-2H3
InChIKeyOVFGIIYCABUMOQ-UHFFFAOYSA-N
MW274.45 g/mol
LogP4.82
Rot. Bonds1

About 3,3-dimethyl-7-(5-methyl-2-pyridinyl)-7-azaspiro[3.5]nonane;ethane

3,3-dimethyl-7-(5-methyl-2-pyridinyl)-7-azaspiro[3.5]nonane;ethane (PubChem CID 144539338) has the molecular formula C18H30N2 and a molecular weight of 274.45 g/mol. Its IUPAC name is 3,3-dimethyl-7-(5-methyl-2-pyridinyl)-7-azaspiro[3.5]nonane;ethane.

Molecular Properties

Compound Name3,3-dimethyl-7-(5-methyl-2-pyridinyl)-7-azaspiro[3.5]nonane;ethane
PubChem CID144539338
Molecular FormulaC18H30N2
Molecular Weight274.45 g/mol
Exact Mass274.24
IUPAC Name3,3-dimethyl-7-(5-methyl-2-pyridinyl)-7-azaspiro[3.5]nonane;ethane
SMILESCC.Cc1ccc(N2CCC3(CC2)CCC3(C)C)nc1
InChIInChI=1S/C16H24N2.C2H6/c1-13-4-5-14(17-12-13)18-10-8-16(9-11-18)7-6-15(16,2)3;1-2/h4-5,12H,6-11H2,1-3H3;1-2H3
InChIKeyOVFGIIYCABUMOQ-UHFFFAOYSA-N
XLogP4.82
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.45
LogP ≤ 54.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;[4-fluoro-1-(5-methyl-2-pyridinyl)piperidin-4-yl]methanol
CID 172630694
8-(5-methyl-2-pyridinyl)-1,4-dioxa-8-azaspiro[4.5]decane
CID 79026576
CID 59766715
CID 59766715
2-[4-(5-methyl-2-pyridinyl)piperazin-1-yl]pyrimidine
CID 59676617
butane;5-methyl-2-piperidin-1-ylpyridine
CID 170641231
ethane;1-(5-methyl-2-pyridinyl)-4-methylsulfonylpiperazine
CID 143863753
ethane;1-methyl-4-[1-(5-methyl-2-pyridinyl)piperidin-4-yl]piperazine
CID 144607293
1-(5-methyl-2-pyridinyl)-4-(2-methylsulfanylethyl)piperazine
CID 143774965
4-[4-(5-methyl-2-pyridinyl)piperazin-1-yl]butan-1-amine
CID 43252517
5-chloro-2-(4,4-dimethylpiperidin-1-yl)pyridine
CID 66233669
6-(5-chloro-2-pyridinyl)-2,2-difluoro-6-azaspiro[2.5]octane
CID 172899520
1-(5-methyl-2-pyridinyl)-4-(2-phenylethyl)piperazine
CID 171337954

Frequently Asked Questions

What is the IUPAC name of 3,3-dimethyl-7-(5-methyl-2-pyridinyl)-7-azaspiro[3.5]nonane;ethane?
The IUPAC name of 3,3-dimethyl-7-(5-methyl-2-pyridinyl)-7-azaspiro[3.5]nonane;ethane (CID 144539338) is 3,3-dimethyl-7-(5-methyl-2-pyridinyl)-7-azaspiro[3.5]nonane;ethane.
What is the SMILES notation for 3,3-dimethyl-7-(5-methyl-2-pyridinyl)-7-azaspiro[3.5]nonane;ethane?
The canonical SMILES for 3,3-dimethyl-7-(5-methyl-2-pyridinyl)-7-azaspiro[3.5]nonane;ethane is CC.Cc1ccc(N2CCC3(CC2)CCC3(C)C)nc1.
What is the InChIKey of 3,3-dimethyl-7-(5-methyl-2-pyridinyl)-7-azaspiro[3.5]nonane;ethane?
The InChIKey is OVFGIIYCABUMOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2.C2H6/c1-13-4-5-14(17-12-13)18-10-8-16(9-11-18)7-6-15(16,2)3;1-2/h4-5,12H,6-11H2,1-3H3;1-2H3.
What are the key properties of 3,3-dimethyl-7-(5-methyl-2-pyridinyl)-7-azaspiro[3.5]nonane;ethane?
3,3-dimethyl-7-(5-methyl-2-pyridinyl)-7-azaspiro[3.5]nonane;ethane has a molecular weight of 274.45 g/mol, XLogP of 4.82, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethyl-7-(5-methyl-2-pyridinyl)-7-azaspiro[3.5]nonane;ethane is sourced from PubChem (CID 144539338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).