azetidin-3-yl-(8-methyl-2,8-diazaspiro[4.5]decan-2-yl)methanone

C13H23N3O — CID 50951587

IUPACazetidin-3-yl-(8-methyl-2,8-diazaspiro[4.5]decan-2-yl)methanone
SMILESCN1CCC2(CC1)CCN(C(=O)C1CNC1)C2
InChIInChI=1S/C13H23N3O/c1-15-5-2-13(3-6-15)4-7-16(10-13)12(17)11-8-14-9-11/h11,14H,2-10H2,1H3
InChIKeyUBRRGUZKADDIFR-UHFFFAOYSA-N
MW237.35 g/mol
LogP0.15
Rot. Bonds1

About azetidin-3-yl-(8-methyl-2,8-diazaspiro[4.5]decan-2-yl)methanone

azetidin-3-yl-(8-methyl-2,8-diazaspiro[4.5]decan-2-yl)methanone (PubChem CID 50951587) has the molecular formula C13H23N3O and a molecular weight of 237.35 g/mol. Its IUPAC name is azetidin-3-yl-(8-methyl-2,8-diazaspiro[4.5]decan-2-yl)methanone.

Molecular Properties

Compound Nameazetidin-3-yl-(8-methyl-2,8-diazaspiro[4.5]decan-2-yl)methanone
PubChem CID50951587
Molecular FormulaC13H23N3O
Molecular Weight237.35 g/mol
Exact Mass237.18
IUPAC Nameazetidin-3-yl-(8-methyl-2,8-diazaspiro[4.5]decan-2-yl)methanone
SMILESCN1CCC2(CC1)CCN(C(=O)C1CNC1)C2
InChIInChI=1S/C13H23N3O/c1-15-5-2-13(3-6-15)4-7-16(10-13)12(17)11-8-14-9-11/h11,14H,2-10H2,1H3
InChIKeyUBRRGUZKADDIFR-UHFFFAOYSA-N
XLogP0.15
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 50.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-azaspiro[3.4]octan-6-yl(azetidin-3-yl)methanone
CID 131185783
cyclopropyl-(7-methyl-2,7-diazaspiro[3.5]nonan-2-yl)methanone
CID 126759987
azetidin-3-yl-(4-methylpiperazin-1-yl)methanone;2,2,2-trifluoroacetic acid
CID 121209532
1-(azetidine-3-carbonyl)-N,3-dimethylpyrrolidine-3-carboxamide
CID 106318282
(2-methyl-2,7-diazaspiro[3.5]nonan-7-yl)-(1-methylpiperidin-4-yl)methanone
CID 156836980
ethane;1-[4-(7-methyl-2,7-diazaspiro[3.5]nonane-2-carbonyl)cyclohexyl]ethanone;yttrium
CID 176684065
(6-methyl-6-azaspiro[3.4]octan-2-yl)-piperazin-1-ylmethanone
CID 156836708
azetidin-3-yl-(3-hydroxy-3-methylazetidin-1-yl)methanone
CID 107219278
2-oxa-7-azaspiro[4.4]nonan-7-yl(piperidin-3-yl)methanone
CID 119340778
azetidin-3-yl-(4,5,5,7,7-pentamethyl-1,4-diazocan-1-yl)methanone
CID 91273926
azetidin-3-yl-(3-methoxy-3-methylpiperidin-1-yl)methanone
CID 107392334
cyclobutyl(2,9-diazaspiro[4.5]decan-2-yl)methanone
CID 134068804

Frequently Asked Questions

What is the IUPAC name of azetidin-3-yl-(8-methyl-2,8-diazaspiro[4.5]decan-2-yl)methanone?
The IUPAC name of azetidin-3-yl-(8-methyl-2,8-diazaspiro[4.5]decan-2-yl)methanone (CID 50951587) is azetidin-3-yl-(8-methyl-2,8-diazaspiro[4.5]decan-2-yl)methanone.
What is the SMILES notation for azetidin-3-yl-(8-methyl-2,8-diazaspiro[4.5]decan-2-yl)methanone?
The canonical SMILES for azetidin-3-yl-(8-methyl-2,8-diazaspiro[4.5]decan-2-yl)methanone is CN1CCC2(CC1)CCN(C(=O)C1CNC1)C2.
What is the InChIKey of azetidin-3-yl-(8-methyl-2,8-diazaspiro[4.5]decan-2-yl)methanone?
The InChIKey is UBRRGUZKADDIFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O/c1-15-5-2-13(3-6-15)4-7-16(10-13)12(17)11-8-14-9-11/h11,14H,2-10H2,1H3.
What are the key properties of azetidin-3-yl-(8-methyl-2,8-diazaspiro[4.5]decan-2-yl)methanone?
azetidin-3-yl-(8-methyl-2,8-diazaspiro[4.5]decan-2-yl)methanone has a molecular weight of 237.35 g/mol, XLogP of 0.15, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for azetidin-3-yl-(8-methyl-2,8-diazaspiro[4.5]decan-2-yl)methanone is sourced from PubChem (CID 50951587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).