ethane;3-ethyl-1-propan-2-ylpyrazole;methane;methylcyclopentane;8-methyl-5-oxa-2,8-diazaspiro[3.5]nonane

C24H50N4O — CID 144866532

IUPACethane;3-ethyl-1-propan-2-ylpyrazole;methane;methylcyclopentane;8-methyl-5-oxa-2,8-diazaspiro[3.5]nonane
SMILESC.CC.CC1CCCC1.CCc1ccn(C(C)C)n1.CN1CCOC2(CNC2)C1
InChIInChI=1S/C8H14N2.C7H14N2O.C6H12.C2H6.CH4/c1-4-8-5-6-10(9-8)7(2)3;1-9-2-3-10-7(6-9)4-8-5-7;1-6-4-2-3-5-6;1-2;/h5-7H,4H2,1-3H3;8H,2-6H2,1H3;6H,2-5H2,1H3;1-2H3;1H4
InChIKeyNKUYOFTVTRRRMW-UHFFFAOYSA-N
MW410.69 g/mol
LogP5.18
Rot. Bonds2

About ethane;3-ethyl-1-propan-2-ylpyrazole;methane;methylcyclopentane;8-methyl-5-oxa-2,8-diazaspiro[3.5]nonane

ethane;3-ethyl-1-propan-2-ylpyrazole;methane;methylcyclopentane;8-methyl-5-oxa-2,8-diazaspiro[3.5]nonane (PubChem CID 144866532) has the molecular formula C24H50N4O and a molecular weight of 410.69 g/mol. Its IUPAC name is ethane;3-ethyl-1-propan-2-ylpyrazole;methane;methylcyclopentane;8-methyl-5-oxa-2,8-diazaspiro[3.5]nonane.

Molecular Properties

Compound Nameethane;3-ethyl-1-propan-2-ylpyrazole;methane;methylcyclopentane;8-methyl-5-oxa-2,8-diazaspiro[3.5]nonane
PubChem CID144866532
Molecular FormulaC24H50N4O
Molecular Weight410.69 g/mol
Exact Mass410.40
IUPAC Nameethane;3-ethyl-1-propan-2-ylpyrazole;methane;methylcyclopentane;8-methyl-5-oxa-2,8-diazaspiro[3.5]nonane
SMILESC.CC.CC1CCCC1.CCc1ccn(C(C)C)n1.CN1CCOC2(CNC2)C1
InChIInChI=1S/C8H14N2.C7H14N2O.C6H12.C2H6.CH4/c1-4-8-5-6-10(9-8)7(2)3;1-9-2-3-10-7(6-9)4-8-5-7;1-6-4-2-3-5-6;1-2;/h5-7H,4H2,1-3H3;8H,2-6H2,1H3;6H,2-5H2,1H3;1-2H3;1H4
InChIKeyNKUYOFTVTRRRMW-UHFFFAOYSA-N
XLogP5.18
TPSA42.32 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500410.69
LogP ≤ 55.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze ethane;3-ethyl-1-propan-2-ylpyrazole;methane;methylcyclopentane;8-methyl-5-oxa-2,8-diazaspiro[3.5]nonane 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

N-[(2R)-3-methyl-2-(2-methylpyrazol-3-yl)butyl]-5-oxa-8-azaspiro[3.5]nonane-8-carboxamide
CID 124847930
4-[2-(3,3-Difluorocyclopentyl)pyrazol-3-yl]-1-(oxetan-3-yl)piperidine
CID 141405167
4-[Fluoro-[2-(2-methoxyethyl)pyrazol-3-yl]methyl]piperidine
CID 114277867
3-[2-Fluoro-2-methyl-3-(1-methylpyrazol-3-yl)propyl]morpholine
CID 116011194
3-[3-(1-Butan-2-ylpyrazol-3-yl)-2-fluoro-2-methylpropyl]morpholine
CID 116011265
3-[3-(1-Cyclopentylpyrazol-3-yl)-2-fluoro-2-methylpropyl]morpholine
CID 116011348
3-[2-Fluoro-2-methyl-3-(1-pentan-3-ylpyrazol-3-yl)propyl]morpholine
CID 116011357
3-[2-Fluoro-2-methyl-3-(1-propan-2-ylpyrazol-3-yl)propyl]morpholine
CID 116011385
N-(2-methoxyethyl)-3-(3-propan-2-ylpyrazol-1-yl)propan-1-amine
CID 20605533
4-[3-(3-Propan-2-ylpyrazol-1-yl)propyl]morpholine
CID 20605564
4-[3-(1-Cyclohexylpyrazol-3-yl)propyl]-2,6-dimethylmorpholine
CID 58514037
1-(2-Methoxyethyl)-4-[2-(3-propan-2-ylpyrazol-1-yl)ethyl]piperazine
CID 89707975

Frequently Asked Questions

What is the IUPAC name of ethane;3-ethyl-1-propan-2-ylpyrazole;methane;methylcyclopentane;8-methyl-5-oxa-2,8-diazaspiro[3.5]nonane?
The IUPAC name of ethane;3-ethyl-1-propan-2-ylpyrazole;methane;methylcyclopentane;8-methyl-5-oxa-2,8-diazaspiro[3.5]nonane (CID 144866532) is ethane;3-ethyl-1-propan-2-ylpyrazole;methane;methylcyclopentane;8-methyl-5-oxa-2,8-diazaspiro[3.5]nonane.
What is the SMILES notation for ethane;3-ethyl-1-propan-2-ylpyrazole;methane;methylcyclopentane;8-methyl-5-oxa-2,8-diazaspiro[3.5]nonane?
The canonical SMILES for ethane;3-ethyl-1-propan-2-ylpyrazole;methane;methylcyclopentane;8-methyl-5-oxa-2,8-diazaspiro[3.5]nonane is C.CC.CC1CCCC1.CCc1ccn(C(C)C)n1.CN1CCOC2(CNC2)C1.
What is the InChIKey of ethane;3-ethyl-1-propan-2-ylpyrazole;methane;methylcyclopentane;8-methyl-5-oxa-2,8-diazaspiro[3.5]nonane?
The InChIKey is NKUYOFTVTRRRMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2.C7H14N2O.C6H12.C2H6.CH4/c1-4-8-5-6-10(9-8)7(2)3;1-9-2-3-10-7(6-9)4-8-5-7;1-6-4-2-3-5-6;1-2;/h5-7H,4H2,1-3H3;8H,2-6H2,1H3;6H,2-5H2,1H3;1-2H3;1H4.
What are the key properties of ethane;3-ethyl-1-propan-2-ylpyrazole;methane;methylcyclopentane;8-methyl-5-oxa-2,8-diazaspiro[3.5]nonane?
ethane;3-ethyl-1-propan-2-ylpyrazole;methane;methylcyclopentane;8-methyl-5-oxa-2,8-diazaspiro[3.5]nonane has a molecular weight of 410.69 g/mol, XLogP of 5.18, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-ethyl-1-propan-2-ylpyrazole;methane;methylcyclopentane;8-methyl-5-oxa-2,8-diazaspiro[3.5]nonane is sourced from PubChem (CID 144866532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).