N-(1-methyl-6-oxo-3-pyridinyl)cyclobutanecarboxamide

C11H14N2O2 — CID 47341780

IUPACN-(1-methyl-6-oxo-3-pyridinyl)cyclobutanecarboxamide
SMILESCn1cc(NC(=O)C2CCC2)ccc1=O
InChIInChI=1S/C11H14N2O2/c1-13-7-9(5-6-10(13)14)12-11(15)8-3-2-4-8/h5-8H,2-4H2,1H3,(H,12,15)
InChIKeyZJRYCQXYPQMWRW-UHFFFAOYSA-N
MW206.25 g/mol
LogP1.12
Rot. Bonds2

About N-(1-methyl-6-oxo-3-pyridinyl)cyclobutanecarboxamide

N-(1-methyl-6-oxo-3-pyridinyl)cyclobutanecarboxamide (PubChem CID 47341780) has the molecular formula C11H14N2O2 and a molecular weight of 206.25 g/mol. Its IUPAC name is N-(1-methyl-6-oxo-3-pyridinyl)cyclobutanecarboxamide.

Molecular Properties

Compound NameN-(1-methyl-6-oxo-3-pyridinyl)cyclobutanecarboxamide
PubChem CID47341780
Molecular FormulaC11H14N2O2
Molecular Weight206.25 g/mol
Exact Mass206.11
IUPAC NameN-(1-methyl-6-oxo-3-pyridinyl)cyclobutanecarboxamide
SMILESCn1cc(NC(=O)C2CCC2)ccc1=O
InChIInChI=1S/C11H14N2O2/c1-13-7-9(5-6-10(13)14)12-11(15)8-3-2-4-8/h5-8H,2-4H2,1H3,(H,12,15)
InChIKeyZJRYCQXYPQMWRW-UHFFFAOYSA-N
XLogP1.12
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-methyl-6-oxo-3-pyridinyl)cyclobutanecarboxamide?
The IUPAC name of N-(1-methyl-6-oxo-3-pyridinyl)cyclobutanecarboxamide (CID 47341780) is N-(1-methyl-6-oxo-3-pyridinyl)cyclobutanecarboxamide.
What is the SMILES notation for N-(1-methyl-6-oxo-3-pyridinyl)cyclobutanecarboxamide?
The canonical SMILES for N-(1-methyl-6-oxo-3-pyridinyl)cyclobutanecarboxamide is Cn1cc(NC(=O)C2CCC2)ccc1=O.
What is the InChIKey of N-(1-methyl-6-oxo-3-pyridinyl)cyclobutanecarboxamide?
The InChIKey is ZJRYCQXYPQMWRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2/c1-13-7-9(5-6-10(13)14)12-11(15)8-3-2-4-8/h5-8H,2-4H2,1H3,(H,12,15).
What are the key properties of N-(1-methyl-6-oxo-3-pyridinyl)cyclobutanecarboxamide?
N-(1-methyl-6-oxo-3-pyridinyl)cyclobutanecarboxamide has a molecular weight of 206.25 g/mol, XLogP of 1.12, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methyl-6-oxo-3-pyridinyl)cyclobutanecarboxamide is sourced from PubChem (CID 47341780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).