N-[2-[2-[2-(1H-imidazol-5-yl)ethyl]-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl]-2-oxoethyl]acetamide

C18H27N5O3 — CID 70715593

IUPACN-[2-[2-[2-(1H-imidazol-5-yl)ethyl]-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl]-2-oxoethyl]acetamide
SMILESCC(=O)NCC(=O)N1CCCC2(CCC(=O)N(CCc3cnc[nH]3)C2)C1
InChIInChI=1S/C18H27N5O3/c1-14(24)20-10-17(26)22-7-2-5-18(11-22)6-3-16(25)23(12-18)8-4-15-9-19-13-21-15/h9,13H,2-8,10-12H2,1H3,(H,19,21)(H,20,24)
InChIKeyUMVCORTZRPYBSJ-UHFFFAOYSA-N
MW361.45 g/mol
LogP0.32
Rot. Bonds5

About N-[2-[2-[2-(1H-imidazol-5-yl)ethyl]-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl]-2-oxoethyl]acetamide

N-[2-[2-[2-(1H-imidazol-5-yl)ethyl]-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl]-2-oxoethyl]acetamide (PubChem CID 70715593) has the molecular formula C18H27N5O3 and a molecular weight of 361.45 g/mol. Its IUPAC name is N-[2-[2-[2-(1H-imidazol-5-yl)ethyl]-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl]-2-oxoethyl]acetamide.

Molecular Properties

Compound NameN-[2-[2-[2-(1H-imidazol-5-yl)ethyl]-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl]-2-oxoethyl]acetamide
PubChem CID70715593
Molecular FormulaC18H27N5O3
Molecular Weight361.45 g/mol
Exact Mass361.21
IUPAC NameN-[2-[2-[2-(1H-imidazol-5-yl)ethyl]-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl]-2-oxoethyl]acetamide
SMILESCC(=O)NCC(=O)N1CCCC2(CCC(=O)N(CCc3cnc[nH]3)C2)C1
InChIInChI=1S/C18H27N5O3/c1-14(24)20-10-17(26)22-7-2-5-18(11-22)6-3-16(25)23(12-18)8-4-15-9-19-13-21-15/h9,13H,2-8,10-12H2,1H3,(H,19,21)(H,20,24)
InChIKeyUMVCORTZRPYBSJ-UHFFFAOYSA-N
XLogP0.32
TPSA98.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.45
LogP ≤ 50.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[2-[2-[2-(1H-imidazol-5-yl)ethyl]-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl]-2-oxoethyl]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-[2-[2-[2-(1H-imidazol-5-yl)ethyl]-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl]-2-oxoethyl]acetamide?
The IUPAC name of N-[2-[2-[2-(1H-imidazol-5-yl)ethyl]-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl]-2-oxoethyl]acetamide (CID 70715593) is N-[2-[2-[2-(1H-imidazol-5-yl)ethyl]-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl]-2-oxoethyl]acetamide.
What is the SMILES notation for N-[2-[2-[2-(1H-imidazol-5-yl)ethyl]-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl]-2-oxoethyl]acetamide?
The canonical SMILES for N-[2-[2-[2-(1H-imidazol-5-yl)ethyl]-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl]-2-oxoethyl]acetamide is CC(=O)NCC(=O)N1CCCC2(CCC(=O)N(CCc3cnc[nH]3)C2)C1.
What is the InChIKey of N-[2-[2-[2-(1H-imidazol-5-yl)ethyl]-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl]-2-oxoethyl]acetamide?
The InChIKey is UMVCORTZRPYBSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N5O3/c1-14(24)20-10-17(26)22-7-2-5-18(11-22)6-3-16(25)23(12-18)8-4-15-9-19-13-21-15/h9,13H,2-8,10-12H2,1H3,(H,19,21)(H,20,24).
What are the key properties of N-[2-[2-[2-(1H-imidazol-5-yl)ethyl]-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl]-2-oxoethyl]acetamide?
N-[2-[2-[2-(1H-imidazol-5-yl)ethyl]-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl]-2-oxoethyl]acetamide has a molecular weight of 361.45 g/mol, XLogP of 0.32, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-[2-(1H-imidazol-5-yl)ethyl]-3-oxo-2,8-diazaspiro[5.5]undecan-8-yl]-2-oxoethyl]acetamide is sourced from PubChem (CID 70715593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).