2-(3-amino-2-oxo-1-pyridinyl)-N-(3-methyl-1-bicyclo[3.3.1]nonanyl)acetamide

C17H25N3O2 — CID 167291366

IUPAC2-(3-amino-2-oxo-1-pyridinyl)-N-(3-methyl-1-bicyclo[3.3.1]nonanyl)acetamide
SMILESCC1CC2CCCC(NC(=O)Cn3cccc(N)c3=O)(C1)C2
InChIInChI=1S/C17H25N3O2/c1-12-8-13-4-2-6-17(9-12,10-13)19-15(21)11-20-7-3-5-14(18)16(20)22/h3,5,7,12-13H,2,4,6,8-11,18H2,1H3,(H,19,21)
InChIKeyWSTHKFPSLRNHHO-UHFFFAOYSA-N
MW303.41 g/mol
LogP1.91
Rot. Bonds3

About 2-(3-amino-2-oxo-1-pyridinyl)-N-(3-methyl-1-bicyclo[3.3.1]nonanyl)acetamide

2-(3-amino-2-oxo-1-pyridinyl)-N-(3-methyl-1-bicyclo[3.3.1]nonanyl)acetamide (PubChem CID 167291366) has the molecular formula C17H25N3O2 and a molecular weight of 303.41 g/mol. Its IUPAC name is 2-(3-amino-2-oxo-1-pyridinyl)-N-(3-methyl-1-bicyclo[3.3.1]nonanyl)acetamide.

Molecular Properties

Compound Name2-(3-amino-2-oxo-1-pyridinyl)-N-(3-methyl-1-bicyclo[3.3.1]nonanyl)acetamide
PubChem CID167291366
Molecular FormulaC17H25N3O2
Molecular Weight303.41 g/mol
Exact Mass303.19
IUPAC Name2-(3-amino-2-oxo-1-pyridinyl)-N-(3-methyl-1-bicyclo[3.3.1]nonanyl)acetamide
SMILESCC1CC2CCCC(NC(=O)Cn3cccc(N)c3=O)(C1)C2
InChIInChI=1S/C17H25N3O2/c1-12-8-13-4-2-6-17(9-12,10-13)19-15(21)11-20-7-3-5-14(18)16(20)22/h3,5,7,12-13H,2,4,6,8-11,18H2,1H3,(H,19,21)
InChIKeyWSTHKFPSLRNHHO-UHFFFAOYSA-N
XLogP1.91
TPSA77.12 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.41
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3-amino-2-oxo-1-pyridinyl)-N-(3-methyl-1-bicyclo[3.3.1]nonanyl)acetamide?
The IUPAC name of 2-(3-amino-2-oxo-1-pyridinyl)-N-(3-methyl-1-bicyclo[3.3.1]nonanyl)acetamide (CID 167291366) is 2-(3-amino-2-oxo-1-pyridinyl)-N-(3-methyl-1-bicyclo[3.3.1]nonanyl)acetamide.
What is the SMILES notation for 2-(3-amino-2-oxo-1-pyridinyl)-N-(3-methyl-1-bicyclo[3.3.1]nonanyl)acetamide?
The canonical SMILES for 2-(3-amino-2-oxo-1-pyridinyl)-N-(3-methyl-1-bicyclo[3.3.1]nonanyl)acetamide is CC1CC2CCCC(NC(=O)Cn3cccc(N)c3=O)(C1)C2.
What is the InChIKey of 2-(3-amino-2-oxo-1-pyridinyl)-N-(3-methyl-1-bicyclo[3.3.1]nonanyl)acetamide?
The InChIKey is WSTHKFPSLRNHHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O2/c1-12-8-13-4-2-6-17(9-12,10-13)19-15(21)11-20-7-3-5-14(18)16(20)22/h3,5,7,12-13H,2,4,6,8-11,18H2,1H3,(H,19,21).
What are the key properties of 2-(3-amino-2-oxo-1-pyridinyl)-N-(3-methyl-1-bicyclo[3.3.1]nonanyl)acetamide?
2-(3-amino-2-oxo-1-pyridinyl)-N-(3-methyl-1-bicyclo[3.3.1]nonanyl)acetamide has a molecular weight of 303.41 g/mol, XLogP of 1.91, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-amino-2-oxo-1-pyridinyl)-N-(3-methyl-1-bicyclo[3.3.1]nonanyl)acetamide is sourced from PubChem (CID 167291366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).