N-methyl-2-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-8-(2-methylpropanoyl)-2,8-diazaspiro[4.5]decan-2-yl]-N-(1-methylpiperidin-4-yl)acetamide

C24H40N6O3 — CID 146072372

IUPACN-methyl-2-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-8-(2-methylpropanoyl)-2,8-diazaspiro[4.5]decan-2-yl]-N-(1-methylpiperidin-4-yl)acetamide
SMILESCc1noc(C2CC3(CCN(C(=O)C(C)C)CC3)CN2CC(=O)N(C)C2CCN(C)CC2)n1
InChIInChI=1S/C24H40N6O3/c1-17(2)23(32)29-12-8-24(9-13-29)14-20(22-25-18(3)26-33-22)30(16-24)15-21(31)28(5)19-6-10-27(4)11-7-19/h17,19-20H,6-16H2,1-5H3
InChIKeyVXPXUQAUCSIYIJ-UHFFFAOYSA-N
MW460.62 g/mol
LogP1.94
Rot. Bonds5

About N-methyl-2-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-8-(2-methylpropanoyl)-2,8-diazaspiro[4.5]decan-2-yl]-N-(1-methylpiperidin-4-yl)acetamide

N-methyl-2-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-8-(2-methylpropanoyl)-2,8-diazaspiro[4.5]decan-2-yl]-N-(1-methylpiperidin-4-yl)acetamide (PubChem CID 146072372) has the molecular formula C24H40N6O3 and a molecular weight of 460.62 g/mol. Its IUPAC name is N-methyl-2-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-8-(2-methylpropanoyl)-2,8-diazaspiro[4.5]decan-2-yl]-N-(1-methylpiperidin-4-yl)acetamide.

Molecular Properties

Compound NameN-methyl-2-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-8-(2-methylpropanoyl)-2,8-diazaspiro[4.5]decan-2-yl]-N-(1-methylpiperidin-4-yl)acetamide
PubChem CID146072372
Molecular FormulaC24H40N6O3
Molecular Weight460.62 g/mol
Exact Mass460.32
IUPAC NameN-methyl-2-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-8-(2-methylpropanoyl)-2,8-diazaspiro[4.5]decan-2-yl]-N-(1-methylpiperidin-4-yl)acetamide
SMILESCc1noc(C2CC3(CCN(C(=O)C(C)C)CC3)CN2CC(=O)N(C)C2CCN(C)CC2)n1
InChIInChI=1S/C24H40N6O3/c1-17(2)23(32)29-12-8-24(9-13-29)14-20(22-25-18(3)26-33-22)30(16-24)15-21(31)28(5)19-6-10-27(4)11-7-19/h17,19-20H,6-16H2,1-5H3
InChIKeyVXPXUQAUCSIYIJ-UHFFFAOYSA-N
XLogP1.94
TPSA86.02 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500460.62
LogP ≤ 51.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze N-methyl-2-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-8-(2-methylpropanoyl)-2,8-diazaspiro[4.5]decan-2-yl]-N-(1-methylpiperidin-4-yl)acetamide with MolForge

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Related Compounds

3-methyl-1-[(3S)-2-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)-2,8-diazaspiro[4.5]decan-8-yl]butan-1-one
CID 164631537
N-(cyclohexylmethyl)-2-[8-(cyclopropanecarbonyl)-3-(3-methyl-1,2,4-oxadiazol-5-yl)-2,8-diazaspiro[4.5]decan-2-yl]acetamide
CID 146072494
2-[8-(cyclopropanecarbonyl)-3-(3-methyl-1,2,4-oxadiazol-5-yl)-2,8-diazaspiro[4.5]decan-2-yl]-N-(2,2-dimethylpropyl)acetamide
CID 146072428
3-cyclopentyl-1-[2-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)-2,8-diazaspiro[4.5]decan-8-yl]propan-1-one
CID 91911324
N-[(2-chlorophenyl)methyl]-2-[8-(cyclopropanecarbonyl)-3-(3-methyl-1,2,4-oxadiazol-5-yl)-2,8-diazaspiro[4.5]decan-2-yl]acetamide
CID 146072434
1-[2-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)-2,8-diazaspiro[4.5]decan-8-yl]-2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]ethanone
CID 91923453
2-(1H-indol-3-yl)-1-[2-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)-2,8-diazaspiro[4.5]decan-8-yl]ethanone
CID 91911322
2-[2-(dimethylamino)-2-oxoethyl]-N-ethyl-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2,8-diazaspiro[4.5]decane-8-carboxamide
CID 146067279
N-[(2-methoxyphenyl)methyl]-2-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-8-methylsulfonyl-2,8-diazaspiro[4.5]decan-2-yl]acetamide
CID 146072448
N-[(3,4-dimethylphenyl)methyl]-2-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-8-methylsulfonyl-2,8-diazaspiro[4.5]decan-2-yl]acetamide
CID 146072451
1-[7-acetyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)-2,7-diazaspiro[3.4]octan-2-yl]-2-methylpropan-1-one
CID 138987399
2-[8-(3-cyclopentylpropanoyl)-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2,8-diazaspiro[4.5]decan-2-yl]-N,N-dimethylacetamide
CID 146067273

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-8-(2-methylpropanoyl)-2,8-diazaspiro[4.5]decan-2-yl]-N-(1-methylpiperidin-4-yl)acetamide?
The IUPAC name of N-methyl-2-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-8-(2-methylpropanoyl)-2,8-diazaspiro[4.5]decan-2-yl]-N-(1-methylpiperidin-4-yl)acetamide (CID 146072372) is N-methyl-2-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-8-(2-methylpropanoyl)-2,8-diazaspiro[4.5]decan-2-yl]-N-(1-methylpiperidin-4-yl)acetamide.
What is the SMILES notation for N-methyl-2-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-8-(2-methylpropanoyl)-2,8-diazaspiro[4.5]decan-2-yl]-N-(1-methylpiperidin-4-yl)acetamide?
The canonical SMILES for N-methyl-2-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-8-(2-methylpropanoyl)-2,8-diazaspiro[4.5]decan-2-yl]-N-(1-methylpiperidin-4-yl)acetamide is Cc1noc(C2CC3(CCN(C(=O)C(C)C)CC3)CN2CC(=O)N(C)C2CCN(C)CC2)n1.
What is the InChIKey of N-methyl-2-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-8-(2-methylpropanoyl)-2,8-diazaspiro[4.5]decan-2-yl]-N-(1-methylpiperidin-4-yl)acetamide?
The InChIKey is VXPXUQAUCSIYIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H40N6O3/c1-17(2)23(32)29-12-8-24(9-13-29)14-20(22-25-18(3)26-33-22)30(16-24)15-21(31)28(5)19-6-10-27(4)11-7-19/h17,19-20H,6-16H2,1-5H3.
What are the key properties of N-methyl-2-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-8-(2-methylpropanoyl)-2,8-diazaspiro[4.5]decan-2-yl]-N-(1-methylpiperidin-4-yl)acetamide?
N-methyl-2-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-8-(2-methylpropanoyl)-2,8-diazaspiro[4.5]decan-2-yl]-N-(1-methylpiperidin-4-yl)acetamide has a molecular weight of 460.62 g/mol, XLogP of 1.94, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-8-(2-methylpropanoyl)-2,8-diazaspiro[4.5]decan-2-yl]-N-(1-methylpiperidin-4-yl)acetamide is sourced from PubChem (CID 146072372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).