8-methyl-N-(2-pyridin-3-ylethyl)-2-azaspiro[4.4]nonane-2-carboxamide

C17H25N3O — CID 146131989

IUPAC8-methyl-N-(2-pyridin-3-ylethyl)-2-azaspiro[4.4]nonane-2-carboxamide
SMILESCC1CCC2(CCN(C(=O)NCCc3cccnc3)C2)C1
InChIInChI=1S/C17H25N3O/c1-14-4-6-17(11-14)7-10-20(13-17)16(21)19-9-5-15-3-2-8-18-12-15/h2-3,8,12,14H,4-7,9-11,13H2,1H3,(H,19,21)
InChIKeyUCGBUBBOYQLNIK-UHFFFAOYSA-N
MW287.41 g/mol
LogP2.85
Rot. Bonds3

About 8-methyl-N-(2-pyridin-3-ylethyl)-2-azaspiro[4.4]nonane-2-carboxamide

8-methyl-N-(2-pyridin-3-ylethyl)-2-azaspiro[4.4]nonane-2-carboxamide (PubChem CID 146131989) has the molecular formula C17H25N3O and a molecular weight of 287.41 g/mol. Its IUPAC name is 8-methyl-N-(2-pyridin-3-ylethyl)-2-azaspiro[4.4]nonane-2-carboxamide.

Molecular Properties

Compound Name8-methyl-N-(2-pyridin-3-ylethyl)-2-azaspiro[4.4]nonane-2-carboxamide
PubChem CID146131989
Molecular FormulaC17H25N3O
Molecular Weight287.41 g/mol
Exact Mass287.20
IUPAC Name8-methyl-N-(2-pyridin-3-ylethyl)-2-azaspiro[4.4]nonane-2-carboxamide
SMILESCC1CCC2(CCN(C(=O)NCCc3cccnc3)C2)C1
InChIInChI=1S/C17H25N3O/c1-14-4-6-17(11-14)7-10-20(13-17)16(21)19-9-5-15-3-2-8-18-12-15/h2-3,8,12,14H,4-7,9-11,13H2,1H3,(H,19,21)
InChIKeyUCGBUBBOYQLNIK-UHFFFAOYSA-N
XLogP2.85
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3S)-8-methyl-2-propyl-N-(2-pyridin-3-ylethyl)-2,8-diazaspiro[4.5]decane-3-carboxamide
CID 95895228
N-(2-pyridin-3-ylethyl)morpholine-4-carboxamide
CID 110872249
3-methyl-3-phenyl-N-(pyridin-3-ylmethyl)pyrrolidine-1-carboxamide
CID 166233761
2-methyl-N-(2-pyridin-3-ylethyl)spiro[indole-3,4'-piperidine]-1'-carboxamide
CID 136568238
N',4-dimethyl-N-(2-pyridin-3-ylethyl)piperidine-1-carboximidamide
CID 111211399
(2R,3S)-N-(pyridin-3-ylmethyl)-2-(pyrrolidine-1-carbonyl)-5-azaspiro[2.4]heptane-5-carboxamide
CID 97396668
2-(hydroxymethyl)-N-(2-pyridin-3-ylethyl)pyrrolidine-1-carboxamide
CID 111427847
[3-methyl-1-(2-pyridin-3-ylethylamino)cyclohexyl]methanol
CID 63265044
N',3-dimethyl-N-(2-pyridin-3-ylethyl)piperidine-1-carboximidamide
CID 111145936
(3R)-N-(2-phenylethyl)-3-(pyridin-3-ylamino)pyrrolidine-1-carboxamide
CID 95107540
4-[4-(4-methylpiperidin-1-yl)phenyl]-N-(pyridin-3-ylmethyl)piperazine-1-carboxamide
CID 113108615
1-propyl-3-(2-pyridin-3-ylethyl)urea
CID 115578203

Frequently Asked Questions

What is the IUPAC name of 8-methyl-N-(2-pyridin-3-ylethyl)-2-azaspiro[4.4]nonane-2-carboxamide?
The IUPAC name of 8-methyl-N-(2-pyridin-3-ylethyl)-2-azaspiro[4.4]nonane-2-carboxamide (CID 146131989) is 8-methyl-N-(2-pyridin-3-ylethyl)-2-azaspiro[4.4]nonane-2-carboxamide.
What is the SMILES notation for 8-methyl-N-(2-pyridin-3-ylethyl)-2-azaspiro[4.4]nonane-2-carboxamide?
The canonical SMILES for 8-methyl-N-(2-pyridin-3-ylethyl)-2-azaspiro[4.4]nonane-2-carboxamide is CC1CCC2(CCN(C(=O)NCCc3cccnc3)C2)C1.
What is the InChIKey of 8-methyl-N-(2-pyridin-3-ylethyl)-2-azaspiro[4.4]nonane-2-carboxamide?
The InChIKey is UCGBUBBOYQLNIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O/c1-14-4-6-17(11-14)7-10-20(13-17)16(21)19-9-5-15-3-2-8-18-12-15/h2-3,8,12,14H,4-7,9-11,13H2,1H3,(H,19,21).
What are the key properties of 8-methyl-N-(2-pyridin-3-ylethyl)-2-azaspiro[4.4]nonane-2-carboxamide?
8-methyl-N-(2-pyridin-3-ylethyl)-2-azaspiro[4.4]nonane-2-carboxamide has a molecular weight of 287.41 g/mol, XLogP of 2.85, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-N-(2-pyridin-3-ylethyl)-2-azaspiro[4.4]nonane-2-carboxamide is sourced from PubChem (CID 146131989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).