N-[1-(2-methoxyethyl)-2-oxo-1-azaspiro[4.5]decan-8-yl]-2-thiophen-2-ylacetamide

C18H26N2O3S — CID 97397435

IUPACN-[1-(2-methoxyethyl)-2-oxo-1-azaspiro[4.5]decan-8-yl]-2-thiophen-2-ylacetamide
SMILESCOCCN1C(=O)CCC12CCC(NC(=O)Cc1cccs1)CC2
InChIInChI=1S/C18H26N2O3S/c1-23-11-10-20-17(22)6-9-18(20)7-4-14(5-8-18)19-16(21)13-15-3-2-12-24-15/h2-3,12,14H,4-11,13H2,1H3,(H,19,21)
InChIKeyICQXAVOEJMHGPZ-UHFFFAOYSA-N
MW350.48 g/mol
LogP2.36
Rot. Bonds6

About N-[1-(2-methoxyethyl)-2-oxo-1-azaspiro[4.5]decan-8-yl]-2-thiophen-2-ylacetamide

N-[1-(2-methoxyethyl)-2-oxo-1-azaspiro[4.5]decan-8-yl]-2-thiophen-2-ylacetamide (PubChem CID 97397435) has the molecular formula C18H26N2O3S and a molecular weight of 350.48 g/mol. Its IUPAC name is N-[1-(2-methoxyethyl)-2-oxo-1-azaspiro[4.5]decan-8-yl]-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-[1-(2-methoxyethyl)-2-oxo-1-azaspiro[4.5]decan-8-yl]-2-thiophen-2-ylacetamide
PubChem CID97397435
Molecular FormulaC18H26N2O3S
Molecular Weight350.48 g/mol
Exact Mass350.17
IUPAC NameN-[1-(2-methoxyethyl)-2-oxo-1-azaspiro[4.5]decan-8-yl]-2-thiophen-2-ylacetamide
SMILESCOCCN1C(=O)CCC12CCC(NC(=O)Cc1cccs1)CC2
InChIInChI=1S/C18H26N2O3S/c1-23-11-10-20-17(22)6-9-18(20)7-4-14(5-8-18)19-16(21)13-15-3-2-12-24-15/h2-3,12,14H,4-11,13H2,1H3,(H,19,21)
InChIKeyICQXAVOEJMHGPZ-UHFFFAOYSA-N
XLogP2.36
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.48
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-(2-methoxyethyl)-2-oxo-1-azaspiro[4.5]decan-8-yl]-2-thiophen-2-ylacetamide?
The IUPAC name of N-[1-(2-methoxyethyl)-2-oxo-1-azaspiro[4.5]decan-8-yl]-2-thiophen-2-ylacetamide (CID 97397435) is N-[1-(2-methoxyethyl)-2-oxo-1-azaspiro[4.5]decan-8-yl]-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-[1-(2-methoxyethyl)-2-oxo-1-azaspiro[4.5]decan-8-yl]-2-thiophen-2-ylacetamide?
The canonical SMILES for N-[1-(2-methoxyethyl)-2-oxo-1-azaspiro[4.5]decan-8-yl]-2-thiophen-2-ylacetamide is COCCN1C(=O)CCC12CCC(NC(=O)Cc1cccs1)CC2.
What is the InChIKey of N-[1-(2-methoxyethyl)-2-oxo-1-azaspiro[4.5]decan-8-yl]-2-thiophen-2-ylacetamide?
The InChIKey is ICQXAVOEJMHGPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O3S/c1-23-11-10-20-17(22)6-9-18(20)7-4-14(5-8-18)19-16(21)13-15-3-2-12-24-15/h2-3,12,14H,4-11,13H2,1H3,(H,19,21).
What are the key properties of N-[1-(2-methoxyethyl)-2-oxo-1-azaspiro[4.5]decan-8-yl]-2-thiophen-2-ylacetamide?
N-[1-(2-methoxyethyl)-2-oxo-1-azaspiro[4.5]decan-8-yl]-2-thiophen-2-ylacetamide has a molecular weight of 350.48 g/mol, XLogP of 2.36, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-methoxyethyl)-2-oxo-1-azaspiro[4.5]decan-8-yl]-2-thiophen-2-ylacetamide is sourced from PubChem (CID 97397435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).