9-methyl-1-[[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl]-1,9-diazaspiro[4.5]decan-10-one

C19H24N4O2 — CID 162628944

IUPAC9-methyl-1-[[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl]-1,9-diazaspiro[4.5]decan-10-one
SMILESCc1ccc(-c2nc(CN3CCCC34CCCN(C)C4=O)no2)cc1
InChIInChI=1S/C19H24N4O2/c1-14-5-7-15(8-6-14)17-20-16(21-25-17)13-23-12-4-10-19(23)9-3-11-22(2)18(19)24/h5-8H,3-4,9-13H2,1-2H3
InChIKeyFJPUCCDCNOZLCT-UHFFFAOYSA-N
MW340.43 g/mol
LogP2.63
Rot. Bonds3

About 9-methyl-1-[[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl]-1,9-diazaspiro[4.5]decan-10-one

9-methyl-1-[[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl]-1,9-diazaspiro[4.5]decan-10-one (PubChem CID 162628944) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is 9-methyl-1-[[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl]-1,9-diazaspiro[4.5]decan-10-one.

Molecular Properties

Compound Name9-methyl-1-[[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl]-1,9-diazaspiro[4.5]decan-10-one
PubChem CID162628944
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC Name9-methyl-1-[[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl]-1,9-diazaspiro[4.5]decan-10-one
SMILESCc1ccc(-c2nc(CN3CCCC34CCCN(C)C4=O)no2)cc1
InChIInChI=1S/C19H24N4O2/c1-14-5-7-15(8-6-14)17-20-16(21-25-17)13-23-12-4-10-19(23)9-3-11-22(2)18(19)24/h5-8H,3-4,9-13H2,1-2H3
InChIKeyFJPUCCDCNOZLCT-UHFFFAOYSA-N
XLogP2.63
TPSA62.47 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 9-methyl-1-[[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl]-1,9-diazaspiro[4.5]decan-10-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-(4-methylphenyl)-3-(piperazin-1-ylmethyl)-1,2,4-oxadiazole
CID 43348682
5-methyl-5-(4-methylphenyl)-3-[[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl]imidazolidine-2,4-dione
CID 43047103
3-[(4-ethylsulfonylpiperazin-1-yl)methyl]-5-(4-methylphenyl)-1,2,4-oxadiazole
CID 42879831
5-(4-methylphenyl)-3-[(3-piperidin-1-ylazetidin-1-yl)methyl]-1,2,4-oxadiazole
CID 91840884
1-[(3-ethyl-1,2-oxazol-5-yl)methyl]-9-(4-methylphenyl)-1,9-diazaspiro[4.5]decan-10-one
CID 162629044
(3R)-1-[[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl]pyrrolidin-3-ol
CID 78963885
1-[[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl]piperidine-3-carbaldehyde
CID 62655496
1-[(6-methoxy-3-pyridinyl)methyl]-9-methyl-1,9-diazaspiro[4.5]decan-10-one
CID 162635875
N-cyclopentyl-1-[[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl]piperidine-3-carboxamide
CID 50814408
(3S)-N-cyclopentyl-1-[[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl]piperidine-3-carboxamide
CID 92733295
1-[(6-chloro-2H-chromen-3-yl)methyl]-9-methyl-1,9-diazaspiro[4.5]decan-10-one
CID 163314072
4-ethyl-2-[[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl]-5-[(3R)-piperidin-3-yl]-1,2,4-triazol-3-one
CID 95212980

Frequently Asked Questions

What is the IUPAC name of 9-methyl-1-[[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl]-1,9-diazaspiro[4.5]decan-10-one?
The IUPAC name of 9-methyl-1-[[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl]-1,9-diazaspiro[4.5]decan-10-one (CID 162628944) is 9-methyl-1-[[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl]-1,9-diazaspiro[4.5]decan-10-one.
What is the SMILES notation for 9-methyl-1-[[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl]-1,9-diazaspiro[4.5]decan-10-one?
The canonical SMILES for 9-methyl-1-[[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl]-1,9-diazaspiro[4.5]decan-10-one is Cc1ccc(-c2nc(CN3CCCC34CCCN(C)C4=O)no2)cc1.
What is the InChIKey of 9-methyl-1-[[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl]-1,9-diazaspiro[4.5]decan-10-one?
The InChIKey is FJPUCCDCNOZLCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-14-5-7-15(8-6-14)17-20-16(21-25-17)13-23-12-4-10-19(23)9-3-11-22(2)18(19)24/h5-8H,3-4,9-13H2,1-2H3.
What are the key properties of 9-methyl-1-[[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl]-1,9-diazaspiro[4.5]decan-10-one?
9-methyl-1-[[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl]-1,9-diazaspiro[4.5]decan-10-one has a molecular weight of 340.43 g/mol, XLogP of 2.63, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-1-[[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl]-1,9-diazaspiro[4.5]decan-10-one is sourced from PubChem (CID 162628944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).