2-[1-(6,9-diazaspiro[4.5]decan-9-yl)ethyl]-5-methyl-1,3-oxazole

C14H23N3O — CID 106389916

IUPAC2-[1-(6,9-diazaspiro[4.5]decan-9-yl)ethyl]-5-methyl-1,3-oxazole
SMILESCc1cnc(C(C)N2CCNC3(CCCC3)C2)o1
InChIInChI=1S/C14H23N3O/c1-11-9-15-13(18-11)12(2)17-8-7-16-14(10-17)5-3-4-6-14/h9,12,16H,3-8,10H2,1-2H3
InChIKeyIJPBBJRJVXGRCH-UHFFFAOYSA-N
MW249.36 g/mol
LogP2.26
Rot. Bonds2

About 2-[1-(6,9-diazaspiro[4.5]decan-9-yl)ethyl]-5-methyl-1,3-oxazole

2-[1-(6,9-diazaspiro[4.5]decan-9-yl)ethyl]-5-methyl-1,3-oxazole (PubChem CID 106389916) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is 2-[1-(6,9-diazaspiro[4.5]decan-9-yl)ethyl]-5-methyl-1,3-oxazole.

Molecular Properties

Compound Name2-[1-(6,9-diazaspiro[4.5]decan-9-yl)ethyl]-5-methyl-1,3-oxazole
PubChem CID106389916
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name2-[1-(6,9-diazaspiro[4.5]decan-9-yl)ethyl]-5-methyl-1,3-oxazole
SMILESCc1cnc(C(C)N2CCNC3(CCCC3)C2)o1
InChIInChI=1S/C14H23N3O/c1-11-9-15-13(18-11)12(2)17-8-7-16-14(10-17)5-3-4-6-14/h9,12,16H,3-8,10H2,1-2H3
InChIKeyIJPBBJRJVXGRCH-UHFFFAOYSA-N
XLogP2.26
TPSA41.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[1-(6,9-diazaspiro[4.5]decan-9-yl)ethyl]-5-methyl-1,3-oxazole 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

2-[1-(3,3-diethylpiperazin-1-yl)ethyl]-5-methyl-1,3-oxazole
CID 106389939
4-[1-(4-fluorophenyl)ethyl]-1,4-diazaspiro[5.5]undecane
CID 64925547
9-(3-methylbutan-2-yl)-6,9-diazaspiro[4.5]decane
CID 64923852
5-methyl-2-[1-(3-propylpiperazin-1-yl)ethyl]-1,3-oxazole
CID 106389972
4-[1-(3-bromophenyl)ethyl]-1,4-diazaspiro[5.5]undecane
CID 64953315
1-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-N-propan-2-ylpiperidin-3-amine
CID 103895042
4-propan-2-yl-1,4,9-triazaspiro[5.5]undecane
CID 139359285
5-methyl-2-[1-(3-phenyl-1,4-diazepan-1-yl)ethyl]-1,3-oxazole
CID 106389948
2-[1-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)ethyl]-5-methyl-1,3-oxazole
CID 103895043
11-[1-(2-chlorophenyl)ethyl]-7,11-diazaspiro[5.6]dodecane
CID 64943252
4-[(1S)-1-[6-(4-fluoropyrazol-1-yl)-3-pyridinyl]ethyl]-1,4,9-triazaspiro[5.5]undecane
CID 146665700
2-[1-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)ethyl]-5-methyl-1,3-oxazole
CID 106389937

Frequently Asked Questions

What is the IUPAC name of 2-[1-(6,9-diazaspiro[4.5]decan-9-yl)ethyl]-5-methyl-1,3-oxazole?
The IUPAC name of 2-[1-(6,9-diazaspiro[4.5]decan-9-yl)ethyl]-5-methyl-1,3-oxazole (CID 106389916) is 2-[1-(6,9-diazaspiro[4.5]decan-9-yl)ethyl]-5-methyl-1,3-oxazole.
What is the SMILES notation for 2-[1-(6,9-diazaspiro[4.5]decan-9-yl)ethyl]-5-methyl-1,3-oxazole?
The canonical SMILES for 2-[1-(6,9-diazaspiro[4.5]decan-9-yl)ethyl]-5-methyl-1,3-oxazole is Cc1cnc(C(C)N2CCNC3(CCCC3)C2)o1.
What is the InChIKey of 2-[1-(6,9-diazaspiro[4.5]decan-9-yl)ethyl]-5-methyl-1,3-oxazole?
The InChIKey is IJPBBJRJVXGRCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-11-9-15-13(18-11)12(2)17-8-7-16-14(10-17)5-3-4-6-14/h9,12,16H,3-8,10H2,1-2H3.
What are the key properties of 2-[1-(6,9-diazaspiro[4.5]decan-9-yl)ethyl]-5-methyl-1,3-oxazole?
2-[1-(6,9-diazaspiro[4.5]decan-9-yl)ethyl]-5-methyl-1,3-oxazole has a molecular weight of 249.36 g/mol, XLogP of 2.26, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(6,9-diazaspiro[4.5]decan-9-yl)ethyl]-5-methyl-1,3-oxazole is sourced from PubChem (CID 106389916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).