2,7-diazaspiro[4.5]decan-7-yl-(3-ethyl-4-pyridinyl)methanone

C16H23N3O — CID 154762707

IUPAC2,7-diazaspiro[4.5]decan-7-yl-(3-ethyl-4-pyridinyl)methanone
SMILESCCc1cnccc1C(=O)N1CCCC2(CCNC2)C1
InChIInChI=1S/C16H23N3O/c1-2-13-10-17-7-4-14(13)15(20)19-9-3-5-16(12-19)6-8-18-11-16/h4,7,10,18H,2-3,5-6,8-9,11-12H2,1H3
InChIKeyGLFXGOILEPDZSG-UHFFFAOYSA-N
MW273.38 g/mol
LogP1.86
Rot. Bonds2

About 2,7-diazaspiro[4.5]decan-7-yl-(3-ethyl-4-pyridinyl)methanone

2,7-diazaspiro[4.5]decan-7-yl-(3-ethyl-4-pyridinyl)methanone (PubChem CID 154762707) has the molecular formula C16H23N3O and a molecular weight of 273.38 g/mol. Its IUPAC name is 2,7-diazaspiro[4.5]decan-7-yl-(3-ethyl-4-pyridinyl)methanone.

Molecular Properties

Compound Name2,7-diazaspiro[4.5]decan-7-yl-(3-ethyl-4-pyridinyl)methanone
PubChem CID154762707
Molecular FormulaC16H23N3O
Molecular Weight273.38 g/mol
Exact Mass273.18
IUPAC Name2,7-diazaspiro[4.5]decan-7-yl-(3-ethyl-4-pyridinyl)methanone
SMILESCCc1cnccc1C(=O)N1CCCC2(CCNC2)C1
InChIInChI=1S/C16H23N3O/c1-2-13-10-17-7-4-14(13)15(20)19-9-3-5-16(12-19)6-8-18-11-16/h4,7,10,18H,2-3,5-6,8-9,11-12H2,1H3
InChIKeyGLFXGOILEPDZSG-UHFFFAOYSA-N
XLogP1.86
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3-ethyl-4-pyridinyl)-[3-hydroxy-3-(2H-triazol-4-yl)piperidin-1-yl]methanone
CID 128981867
2,8-diazaspiro[5.5]undecan-2-yl-(5-methyl-1,2-oxazol-4-yl)methanone
CID 102849787
(2-anilinopyrimidin-5-yl)-[(5S)-2,7-diazaspiro[4.5]decan-7-yl]methanone
CID 95223316
(3-hydroxy-4-pyridinyl)-[(6S)-8-methyl-2,8-diazaspiro[5.5]undecan-2-yl]methanone
CID 99971985
(5-amino-1-methylpyrazol-4-yl)-(2,8-diazaspiro[5.5]undecan-2-yl)methanone
CID 110485292
[(5R)-2,7-diazaspiro[4.5]decan-7-yl]-[6-(diethylaminomethyl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone
CID 95727070
2,8-diazaspiro[5.5]undecan-2-yl-(5-ethylfuran-2-yl)methanone
CID 102849550
1-(2,7-diazaspiro[4.5]decan-7-yl)-2-(2-ethylimidazol-1-yl)ethanone
CID 56746292
[(5R)-2,7-diazaspiro[4.5]decan-7-yl]-thiophen-2-ylmethanone
CID 124554551
2,8-diazaspiro[5.5]undecan-2-yl(1,3-thiazol-5-yl)methanone
CID 114031315
2,8-diazaspiro[5.5]undecan-2-yl-(3,6-dimethylpyridazin-4-yl)methanone
CID 102849821
(2-amino-1,3-thiazol-5-yl)-[(5S)-2,7-diazaspiro[4.5]decan-7-yl]methanone
CID 125443768

Frequently Asked Questions

What is the IUPAC name of 2,7-diazaspiro[4.5]decan-7-yl-(3-ethyl-4-pyridinyl)methanone?
The IUPAC name of 2,7-diazaspiro[4.5]decan-7-yl-(3-ethyl-4-pyridinyl)methanone (CID 154762707) is 2,7-diazaspiro[4.5]decan-7-yl-(3-ethyl-4-pyridinyl)methanone.
What is the SMILES notation for 2,7-diazaspiro[4.5]decan-7-yl-(3-ethyl-4-pyridinyl)methanone?
The canonical SMILES for 2,7-diazaspiro[4.5]decan-7-yl-(3-ethyl-4-pyridinyl)methanone is CCc1cnccc1C(=O)N1CCCC2(CCNC2)C1.
What is the InChIKey of 2,7-diazaspiro[4.5]decan-7-yl-(3-ethyl-4-pyridinyl)methanone?
The InChIKey is GLFXGOILEPDZSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O/c1-2-13-10-17-7-4-14(13)15(20)19-9-3-5-16(12-19)6-8-18-11-16/h4,7,10,18H,2-3,5-6,8-9,11-12H2,1H3.
What are the key properties of 2,7-diazaspiro[4.5]decan-7-yl-(3-ethyl-4-pyridinyl)methanone?
2,7-diazaspiro[4.5]decan-7-yl-(3-ethyl-4-pyridinyl)methanone has a molecular weight of 273.38 g/mol, XLogP of 1.86, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-diazaspiro[4.5]decan-7-yl-(3-ethyl-4-pyridinyl)methanone is sourced from PubChem (CID 154762707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).