8-(1-ethyl-4,6-dimethyl-2-oxopyridine-3-carbonyl)-3-methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one

C18H25N3O4 — CID 70768346

IUPAC8-(1-ethyl-4,6-dimethyl-2-oxopyridine-3-carbonyl)-3-methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one
SMILESCCn1c(C)cc(C)c(C(=O)N2CCC3(CC2)CN(C)C(=O)O3)c1=O
InChIInChI=1S/C18H25N3O4/c1-5-21-13(3)10-12(2)14(16(21)23)15(22)20-8-6-18(7-9-20)11-19(4)17(24)25-18/h10H,5-9,11H2,1-4H3
InChIKeyZQKCKLBHCWJPQH-UHFFFAOYSA-N
MW347.42 g/mol
LogP1.54
Rot. Bonds2

About 8-(1-ethyl-4,6-dimethyl-2-oxopyridine-3-carbonyl)-3-methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one

8-(1-ethyl-4,6-dimethyl-2-oxopyridine-3-carbonyl)-3-methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one (PubChem CID 70768346) has the molecular formula C18H25N3O4 and a molecular weight of 347.42 g/mol. Its IUPAC name is 8-(1-ethyl-4,6-dimethyl-2-oxopyridine-3-carbonyl)-3-methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one.

Molecular Properties

Compound Name8-(1-ethyl-4,6-dimethyl-2-oxopyridine-3-carbonyl)-3-methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one
PubChem CID70768346
Molecular FormulaC18H25N3O4
Molecular Weight347.42 g/mol
Exact Mass347.18
IUPAC Name8-(1-ethyl-4,6-dimethyl-2-oxopyridine-3-carbonyl)-3-methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one
SMILESCCn1c(C)cc(C)c(C(=O)N2CCC3(CC2)CN(C)C(=O)O3)c1=O
InChIInChI=1S/C18H25N3O4/c1-5-21-13(3)10-12(2)14(16(21)23)15(22)20-8-6-18(7-9-20)11-19(4)17(24)25-18/h10H,5-9,11H2,1-4H3
InChIKeyZQKCKLBHCWJPQH-UHFFFAOYSA-N
XLogP1.54
TPSA71.85 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.42
LogP ≤ 51.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 8-(1-ethyl-4,6-dimethyl-2-oxopyridine-3-carbonyl)-3-methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one?
The IUPAC name of 8-(1-ethyl-4,6-dimethyl-2-oxopyridine-3-carbonyl)-3-methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one (CID 70768346) is 8-(1-ethyl-4,6-dimethyl-2-oxopyridine-3-carbonyl)-3-methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one.
What is the SMILES notation for 8-(1-ethyl-4,6-dimethyl-2-oxopyridine-3-carbonyl)-3-methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one?
The canonical SMILES for 8-(1-ethyl-4,6-dimethyl-2-oxopyridine-3-carbonyl)-3-methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one is CCn1c(C)cc(C)c(C(=O)N2CCC3(CC2)CN(C)C(=O)O3)c1=O.
What is the InChIKey of 8-(1-ethyl-4,6-dimethyl-2-oxopyridine-3-carbonyl)-3-methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one?
The InChIKey is ZQKCKLBHCWJPQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O4/c1-5-21-13(3)10-12(2)14(16(21)23)15(22)20-8-6-18(7-9-20)11-19(4)17(24)25-18/h10H,5-9,11H2,1-4H3.
What are the key properties of 8-(1-ethyl-4,6-dimethyl-2-oxopyridine-3-carbonyl)-3-methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one?
8-(1-ethyl-4,6-dimethyl-2-oxopyridine-3-carbonyl)-3-methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one has a molecular weight of 347.42 g/mol, XLogP of 1.54, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(1-ethyl-4,6-dimethyl-2-oxopyridine-3-carbonyl)-3-methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one is sourced from PubChem (CID 70768346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).