5-methyl-N-(2-oxo-1-azaspiro[4.5]decan-8-yl)-1,2-oxazole-3-carboxamide

C14H19N3O3 — CID 97397404

IUPAC5-methyl-N-(2-oxo-1-azaspiro[4.5]decan-8-yl)-1,2-oxazole-3-carboxamide
SMILESCc1cc(C(=O)NC2CCC3(CCC(=O)N3)CC2)no1
InChIInChI=1S/C14H19N3O3/c1-9-8-11(17-20-9)13(19)15-10-2-5-14(6-3-10)7-4-12(18)16-14/h8,10H,2-7H2,1H3,(H,15,19)(H,16,18)
InChIKeyXNKRCUZSZJCTJP-UHFFFAOYSA-N
MW277.32 g/mol
LogP1.30
Rot. Bonds2

About 5-methyl-N-(2-oxo-1-azaspiro[4.5]decan-8-yl)-1,2-oxazole-3-carboxamide

5-methyl-N-(2-oxo-1-azaspiro[4.5]decan-8-yl)-1,2-oxazole-3-carboxamide (PubChem CID 97397404) has the molecular formula C14H19N3O3 and a molecular weight of 277.32 g/mol. Its IUPAC name is 5-methyl-N-(2-oxo-1-azaspiro[4.5]decan-8-yl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-methyl-N-(2-oxo-1-azaspiro[4.5]decan-8-yl)-1,2-oxazole-3-carboxamide
PubChem CID97397404
Molecular FormulaC14H19N3O3
Molecular Weight277.32 g/mol
Exact Mass277.14
IUPAC Name5-methyl-N-(2-oxo-1-azaspiro[4.5]decan-8-yl)-1,2-oxazole-3-carboxamide
SMILESCc1cc(C(=O)NC2CCC3(CCC(=O)N3)CC2)no1
InChIInChI=1S/C14H19N3O3/c1-9-8-11(17-20-9)13(19)15-10-2-5-14(6-3-10)7-4-12(18)16-14/h8,10H,2-7H2,1H3,(H,15,19)(H,16,18)
InChIKeyXNKRCUZSZJCTJP-UHFFFAOYSA-N
XLogP1.30
TPSA84.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(2-oxo-1-azaspiro[4.5]decan-8-yl)-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-methyl-N-(2-oxo-1-azaspiro[4.5]decan-8-yl)-1,2-oxazole-3-carboxamide (CID 97397404) is 5-methyl-N-(2-oxo-1-azaspiro[4.5]decan-8-yl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-methyl-N-(2-oxo-1-azaspiro[4.5]decan-8-yl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-methyl-N-(2-oxo-1-azaspiro[4.5]decan-8-yl)-1,2-oxazole-3-carboxamide is Cc1cc(C(=O)NC2CCC3(CCC(=O)N3)CC2)no1.
What is the InChIKey of 5-methyl-N-(2-oxo-1-azaspiro[4.5]decan-8-yl)-1,2-oxazole-3-carboxamide?
The InChIKey is XNKRCUZSZJCTJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O3/c1-9-8-11(17-20-9)13(19)15-10-2-5-14(6-3-10)7-4-12(18)16-14/h8,10H,2-7H2,1H3,(H,15,19)(H,16,18).
What are the key properties of 5-methyl-N-(2-oxo-1-azaspiro[4.5]decan-8-yl)-1,2-oxazole-3-carboxamide?
5-methyl-N-(2-oxo-1-azaspiro[4.5]decan-8-yl)-1,2-oxazole-3-carboxamide has a molecular weight of 277.32 g/mol, XLogP of 1.30, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(2-oxo-1-azaspiro[4.5]decan-8-yl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 97397404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).