6-methyl-N-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)pyridine-2-carboxamide

C16H20N4O3 — CID 32645806

IUPAC6-methyl-N-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)pyridine-2-carboxamide
SMILESCc1cccc(C(=O)NN2C(=O)NC3(CCC(C)CC3)C2=O)n1
InChIInChI=1S/C16H20N4O3/c1-10-6-8-16(9-7-10)14(22)20(15(23)18-16)19-13(21)12-5-3-4-11(2)17-12/h3-5,10H,6-9H2,1-2H3,(H,18,23)(H,19,21)
InChIKeyZADABDHJDNXNEQ-UHFFFAOYSA-N
MW316.36 g/mol
LogP1.54
Rot. Bonds2

About 6-methyl-N-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)pyridine-2-carboxamide

6-methyl-N-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)pyridine-2-carboxamide (PubChem CID 32645806) has the molecular formula C16H20N4O3 and a molecular weight of 316.36 g/mol. Its IUPAC name is 6-methyl-N-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-methyl-N-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)pyridine-2-carboxamide
PubChem CID32645806
Molecular FormulaC16H20N4O3
Molecular Weight316.36 g/mol
Exact Mass316.15
IUPAC Name6-methyl-N-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)pyridine-2-carboxamide
SMILESCc1cccc(C(=O)NN2C(=O)NC3(CCC(C)CC3)C2=O)n1
InChIInChI=1S/C16H20N4O3/c1-10-6-8-16(9-7-10)14(22)20(15(23)18-16)19-13(21)12-5-3-4-11(2)17-12/h3-5,10H,6-9H2,1-2H3,(H,18,23)(H,19,21)
InChIKeyZADABDHJDNXNEQ-UHFFFAOYSA-N
XLogP1.54
TPSA91.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.36
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)pyridine-2-carboxamide?
The IUPAC name of 6-methyl-N-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)pyridine-2-carboxamide (CID 32645806) is 6-methyl-N-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)pyridine-2-carboxamide.
What is the SMILES notation for 6-methyl-N-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)pyridine-2-carboxamide?
The canonical SMILES for 6-methyl-N-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)pyridine-2-carboxamide is Cc1cccc(C(=O)NN2C(=O)NC3(CCC(C)CC3)C2=O)n1.
What is the InChIKey of 6-methyl-N-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)pyridine-2-carboxamide?
The InChIKey is ZADABDHJDNXNEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O3/c1-10-6-8-16(9-7-10)14(22)20(15(23)18-16)19-13(21)12-5-3-4-11(2)17-12/h3-5,10H,6-9H2,1-2H3,(H,18,23)(H,19,21).
What are the key properties of 6-methyl-N-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)pyridine-2-carboxamide?
6-methyl-N-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)pyridine-2-carboxamide has a molecular weight of 316.36 g/mol, XLogP of 1.54, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)pyridine-2-carboxamide is sourced from PubChem (CID 32645806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).