2-cyclobutyl-N-(1,4-dimethyl-6-oxo-3-pyridinyl)acetamide

C13H18N2O2 — CID 97222129

IUPAC2-cyclobutyl-N-(1,4-dimethyl-6-oxo-3-pyridinyl)acetamide
SMILESCc1cc(=O)n(C)cc1NC(=O)CC1CCC1
InChIInChI=1S/C13H18N2O2/c1-9-6-13(17)15(2)8-11(9)14-12(16)7-10-4-3-5-10/h6,8,10H,3-5,7H2,1-2H3,(H,14,16)
InChIKeySYLCKOUNRHOPTK-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.82
Rot. Bonds3

About 2-cyclobutyl-N-(1,4-dimethyl-6-oxo-3-pyridinyl)acetamide

2-cyclobutyl-N-(1,4-dimethyl-6-oxo-3-pyridinyl)acetamide (PubChem CID 97222129) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is 2-cyclobutyl-N-(1,4-dimethyl-6-oxo-3-pyridinyl)acetamide.

Molecular Properties

Compound Name2-cyclobutyl-N-(1,4-dimethyl-6-oxo-3-pyridinyl)acetamide
PubChem CID97222129
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC Name2-cyclobutyl-N-(1,4-dimethyl-6-oxo-3-pyridinyl)acetamide
SMILESCc1cc(=O)n(C)cc1NC(=O)CC1CCC1
InChIInChI=1S/C13H18N2O2/c1-9-6-13(17)15(2)8-11(9)14-12(16)7-10-4-3-5-10/h6,8,10H,3-5,7H2,1-2H3,(H,14,16)
InChIKeySYLCKOUNRHOPTK-UHFFFAOYSA-N
XLogP1.82
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyl-N-(1,4-dimethyl-6-oxo-3-pyridinyl)acetamide?
The IUPAC name of 2-cyclobutyl-N-(1,4-dimethyl-6-oxo-3-pyridinyl)acetamide (CID 97222129) is 2-cyclobutyl-N-(1,4-dimethyl-6-oxo-3-pyridinyl)acetamide.
What is the SMILES notation for 2-cyclobutyl-N-(1,4-dimethyl-6-oxo-3-pyridinyl)acetamide?
The canonical SMILES for 2-cyclobutyl-N-(1,4-dimethyl-6-oxo-3-pyridinyl)acetamide is Cc1cc(=O)n(C)cc1NC(=O)CC1CCC1.
What is the InChIKey of 2-cyclobutyl-N-(1,4-dimethyl-6-oxo-3-pyridinyl)acetamide?
The InChIKey is SYLCKOUNRHOPTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2/c1-9-6-13(17)15(2)8-11(9)14-12(16)7-10-4-3-5-10/h6,8,10H,3-5,7H2,1-2H3,(H,14,16).
What are the key properties of 2-cyclobutyl-N-(1,4-dimethyl-6-oxo-3-pyridinyl)acetamide?
2-cyclobutyl-N-(1,4-dimethyl-6-oxo-3-pyridinyl)acetamide has a molecular weight of 234.30 g/mol, XLogP of 1.82, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyl-N-(1,4-dimethyl-6-oxo-3-pyridinyl)acetamide is sourced from PubChem (CID 97222129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).