2-[8-(2-cyclohexylacetyl)-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2,8-diazaspiro[4.5]decan-2-yl]-N-cyclopropylacetamide

C26H41N5O3 — CID 146068087

IUPAC2-[8-(2-cyclohexylacetyl)-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2,8-diazaspiro[4.5]decan-2-yl]-N-cyclopropylacetamide
SMILESCC(C)c1nnc(C2CC3(CCN(C(=O)CC4CCCCC4)CC3)CN2CC(=O)NC2CC2)o1
InChIInChI=1S/C26H41N5O3/c1-18(2)24-28-29-25(34-24)21-15-26(17-31(21)16-22(32)27-20-8-9-20)10-12-30(13-11-26)23(33)14-19-6-4-3-5-7-19/h18-21H,3-17H2,1-2H3,(H,27,32)
InChIKeyRETXQPRSQOROQB-UHFFFAOYSA-N
MW471.65 g/mol
LogP3.80
Rot. Bonds7

About 2-[8-(2-cyclohexylacetyl)-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2,8-diazaspiro[4.5]decan-2-yl]-N-cyclopropylacetamide

2-[8-(2-cyclohexylacetyl)-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2,8-diazaspiro[4.5]decan-2-yl]-N-cyclopropylacetamide (PubChem CID 146068087) has the molecular formula C26H41N5O3 and a molecular weight of 471.65 g/mol. Its IUPAC name is 2-[8-(2-cyclohexylacetyl)-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2,8-diazaspiro[4.5]decan-2-yl]-N-cyclopropylacetamide.

Molecular Properties

Compound Name2-[8-(2-cyclohexylacetyl)-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2,8-diazaspiro[4.5]decan-2-yl]-N-cyclopropylacetamide
PubChem CID146068087
Molecular FormulaC26H41N5O3
Molecular Weight471.65 g/mol
Exact Mass471.32
IUPAC Name2-[8-(2-cyclohexylacetyl)-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2,8-diazaspiro[4.5]decan-2-yl]-N-cyclopropylacetamide
SMILESCC(C)c1nnc(C2CC3(CCN(C(=O)CC4CCCCC4)CC3)CN2CC(=O)NC2CC2)o1
InChIInChI=1S/C26H41N5O3/c1-18(2)24-28-29-25(34-24)21-15-26(17-31(21)16-22(32)27-20-8-9-20)10-12-30(13-11-26)23(33)14-19-6-4-3-5-7-19/h18-21H,3-17H2,1-2H3,(H,27,32)
InChIKeyRETXQPRSQOROQB-UHFFFAOYSA-N
XLogP3.80
TPSA91.57 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500471.65
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-[8-(2-cyclohexylacetyl)-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2,8-diazaspiro[4.5]decan-2-yl]-N-cyclopropylacetamide with MolForge

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Related Compounds

2-[8-(3-cyclopentylpropanoyl)-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2,8-diazaspiro[4.5]decan-2-yl]-N-cyclopropylacetamide
CID 146068073
N-cyclopropyl-2-[8-(3-methylbutanoyl)-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2,8-diazaspiro[4.5]decan-2-yl]acetamide
CID 146068068
N-cyclopropyl-2-[8-(3-methylthiophene-2-carbonyl)-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2,8-diazaspiro[4.5]decan-2-yl]acetamide
CID 146067289
N-cyclopropyl-2-[8-(2,4-difluorobenzoyl)-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2,8-diazaspiro[4.5]decan-2-yl]acetamide
CID 146068080
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
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
4-[2-(2-oxo-2-pyrrolidin-1-ylethyl)-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2,8-diazaspiro[4.5]decane-8-carbonyl]-1H-pyridin-2-one
CID 146067216
1-morpholin-4-yl-2-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-8-(pyrimidine-4-carbonyl)-2,8-diazaspiro[4.5]decan-2-yl]ethanone
CID 146070820
1-morpholin-4-yl-2-[8-(3-phenylpropyl)-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2,8-diazaspiro[4.5]decan-2-yl]ethanone
CID 146070821
2-[8-[(1,3-dimethylpyrazol-4-yl)methyl]-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2,8-diazaspiro[4.5]decan-2-yl]-1-morpholin-4-ylethanone
CID 146070875
N,N-dimethyl-2-[8-(4-methylpyridine-3-carbonyl)-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2,8-diazaspiro[4.5]decan-2-yl]acetamide
CID 146067271
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

Frequently Asked Questions

What is the IUPAC name of 2-[8-(2-cyclohexylacetyl)-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2,8-diazaspiro[4.5]decan-2-yl]-N-cyclopropylacetamide?
The IUPAC name of 2-[8-(2-cyclohexylacetyl)-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2,8-diazaspiro[4.5]decan-2-yl]-N-cyclopropylacetamide (CID 146068087) is 2-[8-(2-cyclohexylacetyl)-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2,8-diazaspiro[4.5]decan-2-yl]-N-cyclopropylacetamide.
What is the SMILES notation for 2-[8-(2-cyclohexylacetyl)-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2,8-diazaspiro[4.5]decan-2-yl]-N-cyclopropylacetamide?
The canonical SMILES for 2-[8-(2-cyclohexylacetyl)-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2,8-diazaspiro[4.5]decan-2-yl]-N-cyclopropylacetamide is CC(C)c1nnc(C2CC3(CCN(C(=O)CC4CCCCC4)CC3)CN2CC(=O)NC2CC2)o1.
What is the InChIKey of 2-[8-(2-cyclohexylacetyl)-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2,8-diazaspiro[4.5]decan-2-yl]-N-cyclopropylacetamide?
The InChIKey is RETXQPRSQOROQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H41N5O3/c1-18(2)24-28-29-25(34-24)21-15-26(17-31(21)16-22(32)27-20-8-9-20)10-12-30(13-11-26)23(33)14-19-6-4-3-5-7-19/h18-21H,3-17H2,1-2H3,(H,27,32).
What are the key properties of 2-[8-(2-cyclohexylacetyl)-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2,8-diazaspiro[4.5]decan-2-yl]-N-cyclopropylacetamide?
2-[8-(2-cyclohexylacetyl)-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2,8-diazaspiro[4.5]decan-2-yl]-N-cyclopropylacetamide has a molecular weight of 471.65 g/mol, XLogP of 3.80, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[8-(2-cyclohexylacetyl)-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2,8-diazaspiro[4.5]decan-2-yl]-N-cyclopropylacetamide is sourced from PubChem (CID 146068087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).