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

C16H23N3O3 — CID 97494205

IUPACN-(1-ethyl-2-oxo-1-azaspiro[4.5]decan-8-yl)-5-methyl-1,2-oxazole-3-carboxamide
SMILESCCN1C(=O)CCC12CCC(NC(=O)c1cc(C)on1)CC2
InChIInChI=1S/C16H23N3O3/c1-3-19-14(20)6-9-16(19)7-4-12(5-8-16)17-15(21)13-10-11(2)22-18-13/h10,12H,3-9H2,1-2H3,(H,17,21)
InChIKeyCDJBBSHAYCWXKT-UHFFFAOYSA-N
MW305.38 g/mol
LogP2.04
Rot. Bonds3

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

N-(1-ethyl-2-oxo-1-azaspiro[4.5]decan-8-yl)-5-methyl-1,2-oxazole-3-carboxamide (PubChem CID 97494205) has the molecular formula C16H23N3O3 and a molecular weight of 305.38 g/mol. Its IUPAC name is N-(1-ethyl-2-oxo-1-azaspiro[4.5]decan-8-yl)-5-methyl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-(1-ethyl-2-oxo-1-azaspiro[4.5]decan-8-yl)-5-methyl-1,2-oxazole-3-carboxamide
PubChem CID97494205
Molecular FormulaC16H23N3O3
Molecular Weight305.38 g/mol
Exact Mass305.17
IUPAC NameN-(1-ethyl-2-oxo-1-azaspiro[4.5]decan-8-yl)-5-methyl-1,2-oxazole-3-carboxamide
SMILESCCN1C(=O)CCC12CCC(NC(=O)c1cc(C)on1)CC2
InChIInChI=1S/C16H23N3O3/c1-3-19-14(20)6-9-16(19)7-4-12(5-8-16)17-15(21)13-10-11(2)22-18-13/h10,12H,3-9H2,1-2H3,(H,17,21)
InChIKeyCDJBBSHAYCWXKT-UHFFFAOYSA-N
XLogP2.04
TPSA75.44 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-ethyl-2-oxo-1-azaspiro[4.5]decan-8-yl)-5-methyl-1,2-oxazole-3-carboxamide?
The IUPAC name of N-(1-ethyl-2-oxo-1-azaspiro[4.5]decan-8-yl)-5-methyl-1,2-oxazole-3-carboxamide (CID 97494205) is N-(1-ethyl-2-oxo-1-azaspiro[4.5]decan-8-yl)-5-methyl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-(1-ethyl-2-oxo-1-azaspiro[4.5]decan-8-yl)-5-methyl-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-(1-ethyl-2-oxo-1-azaspiro[4.5]decan-8-yl)-5-methyl-1,2-oxazole-3-carboxamide is CCN1C(=O)CCC12CCC(NC(=O)c1cc(C)on1)CC2.
What is the InChIKey of N-(1-ethyl-2-oxo-1-azaspiro[4.5]decan-8-yl)-5-methyl-1,2-oxazole-3-carboxamide?
The InChIKey is CDJBBSHAYCWXKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O3/c1-3-19-14(20)6-9-16(19)7-4-12(5-8-16)17-15(21)13-10-11(2)22-18-13/h10,12H,3-9H2,1-2H3,(H,17,21).
What are the key properties of N-(1-ethyl-2-oxo-1-azaspiro[4.5]decan-8-yl)-5-methyl-1,2-oxazole-3-carboxamide?
N-(1-ethyl-2-oxo-1-azaspiro[4.5]decan-8-yl)-5-methyl-1,2-oxazole-3-carboxamide has a molecular weight of 305.38 g/mol, XLogP of 2.04, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethyl-2-oxo-1-azaspiro[4.5]decan-8-yl)-5-methyl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 97494205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).