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

C23H37N5O3 — CID 146068068

IUPACN-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
SMILESCC(C)CC(=O)N1CCC2(CC1)CC(c1nnc(C(C)C)o1)N(CC(=O)NC1CC1)C2
InChIInChI=1S/C23H37N5O3/c1-15(2)11-20(30)27-9-7-23(8-10-27)12-18(22-26-25-21(31-22)16(3)4)28(14-23)13-19(29)24-17-5-6-17/h15-18H,5-14H2,1-4H3,(H,24,29)
InChIKeyCBHREDCTNGJKCX-UHFFFAOYSA-N
MW431.58 g/mol
LogP2.87
Rot. Bonds7

About 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

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 (PubChem CID 146068068) has the molecular formula C23H37N5O3 and a molecular weight of 431.58 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound NameN-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
PubChem CID146068068
Molecular FormulaC23H37N5O3
Molecular Weight431.58 g/mol
Exact Mass431.29
IUPAC NameN-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
SMILESCC(C)CC(=O)N1CCC2(CC1)CC(c1nnc(C(C)C)o1)N(CC(=O)NC1CC1)C2
InChIInChI=1S/C23H37N5O3/c1-15(2)11-20(30)27-9-7-23(8-10-27)12-18(22-26-25-21(31-22)16(3)4)28(14-23)13-19(29)24-17-5-6-17/h15-18H,5-14H2,1-4H3,(H,24,29)
InChIKeyCBHREDCTNGJKCX-UHFFFAOYSA-N
XLogP2.87
TPSA91.57 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.58
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 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 with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is CC(C)CC(=O)N1CCC2(CC1)CC(c1nnc(C(C)C)o1)N(CC(=O)NC1CC1)C2.
What is the InChIKey of 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?
The InChIKey is CBHREDCTNGJKCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H37N5O3/c1-15(2)11-20(30)27-9-7-23(8-10-27)12-18(22-26-25-21(31-22)16(3)4)28(14-23)13-19(29)24-17-5-6-17/h15-18H,5-14H2,1-4H3,(H,24,29).
What are the key properties of 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?
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 has a molecular weight of 431.58 g/mol, XLogP of 2.87, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 146068068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).