N-cyclooctyl-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide

C17H26N2O3 — CID 91639863

IUPACN-cyclooctyl-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide
SMILESCOc1cn(CC(=O)NC2CCCCCCC2)c(C)cc1=O
InChIInChI=1S/C17H26N2O3/c1-13-10-15(20)16(22-2)11-19(13)12-17(21)18-14-8-6-4-3-5-7-9-14/h10-11,14H,3-9,12H2,1-2H3,(H,18,21)
InChIKeyISWUZWXXPWCYSO-UHFFFAOYSA-N
MW306.41 g/mol
LogP2.39
Rot. Bonds4

About N-cyclooctyl-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide

N-cyclooctyl-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide (PubChem CID 91639863) has the molecular formula C17H26N2O3 and a molecular weight of 306.41 g/mol. Its IUPAC name is N-cyclooctyl-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide.

Molecular Properties

Compound NameN-cyclooctyl-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide
PubChem CID91639863
Molecular FormulaC17H26N2O3
Molecular Weight306.41 g/mol
Exact Mass306.19
IUPAC NameN-cyclooctyl-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide
SMILESCOc1cn(CC(=O)NC2CCCCCCC2)c(C)cc1=O
InChIInChI=1S/C17H26N2O3/c1-13-10-15(20)16(22-2)11-19(13)12-17(21)18-14-8-6-4-3-5-7-9-14/h10-11,14H,3-9,12H2,1-2H3,(H,18,21)
InChIKeyISWUZWXXPWCYSO-UHFFFAOYSA-N
XLogP2.39
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclooctyl-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide?
The IUPAC name of N-cyclooctyl-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide (CID 91639863) is N-cyclooctyl-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide.
What is the SMILES notation for N-cyclooctyl-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide?
The canonical SMILES for N-cyclooctyl-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide is COc1cn(CC(=O)NC2CCCCCCC2)c(C)cc1=O.
What is the InChIKey of N-cyclooctyl-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide?
The InChIKey is ISWUZWXXPWCYSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O3/c1-13-10-15(20)16(22-2)11-19(13)12-17(21)18-14-8-6-4-3-5-7-9-14/h10-11,14H,3-9,12H2,1-2H3,(H,18,21).
What are the key properties of N-cyclooctyl-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide?
N-cyclooctyl-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide has a molecular weight of 306.41 g/mol, XLogP of 2.39, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclooctyl-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide is sourced from PubChem (CID 91639863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).