N-tert-butyl-2-methyl-6-oxo-1H-pyridine-4-carboxamide

C11H16N2O2 — CID 110698671

IUPACN-tert-butyl-2-methyl-6-oxo-1H-pyridine-4-carboxamide
SMILESCc1cc(C(=O)NC(C)(C)C)cc(=O)[nH]1
InChIInChI=1S/C11H16N2O2/c1-7-5-8(6-9(14)12-7)10(15)13-11(2,3)4/h5-6H,1-4H3,(H,12,14)(H,13,15)
InChIKeyJEYSDDFGVYNVQI-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.21
Rot. Bonds1

About N-tert-butyl-2-methyl-6-oxo-1H-pyridine-4-carboxamide

N-tert-butyl-2-methyl-6-oxo-1H-pyridine-4-carboxamide (PubChem CID 110698671) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is N-tert-butyl-2-methyl-6-oxo-1H-pyridine-4-carboxamide.

Molecular Properties

Compound NameN-tert-butyl-2-methyl-6-oxo-1H-pyridine-4-carboxamide
PubChem CID110698671
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC NameN-tert-butyl-2-methyl-6-oxo-1H-pyridine-4-carboxamide
SMILESCc1cc(C(=O)NC(C)(C)C)cc(=O)[nH]1
InChIInChI=1S/C11H16N2O2/c1-7-5-8(6-9(14)12-7)10(15)13-11(2,3)4/h5-6H,1-4H3,(H,12,14)(H,13,15)
InChIKeyJEYSDDFGVYNVQI-UHFFFAOYSA-N
XLogP1.21
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-methoxy-2-methylpropan-2-yl)-2-methyl-6-oxo-1H-pyridine-4-carboxamide
CID 122569893
N,2-dimethyl-6-oxo-1H-pyridine-4-carboxamide
CID 59355711
2-methyl-6-oxo-1H-pyridine-4-carboxamide
CID 68620934
N-butan-2-yl-2-methyl-6-oxo-1H-pyridine-4-carboxamide
CID 110698591
2-methyl-6-oxo-N-[4-(trifluoromethyl)phenyl]-1H-pyridine-4-carboxamide
CID 110698736
N-cyclohexyl-2-methyl-6-oxo-1H-pyridine-4-carboxamide
CID 110698595
N-(3-bromo-4-methylphenyl)-2-methyl-6-oxo-1H-pyridine-4-carboxamide
CID 110698722
2-methyl-6-oxo-N-[3-(trifluoromethyl)phenyl]-1H-pyridine-4-carboxamide
CID 110698735
N-tert-butyl-2-oxo-1,3-dihydrobenzimidazole-5-carboxamide
CID 110692342
N-(1-hydroxy-2-methylpropan-2-yl)-2-(2-methylpropyl)-6-oxo-1H-pyridine-4-carboxamide
CID 110000936
2-methyl-N-[2-(5-methylthiophen-2-yl)ethyl]-6-oxo-1H-pyridine-4-carboxamide
CID 77083299
2-methyl-6-oxo-N-(pyridin-2-ylmethyl)-1H-pyridine-4-carboxamide
CID 110698624

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-methyl-6-oxo-1H-pyridine-4-carboxamide?
The IUPAC name of N-tert-butyl-2-methyl-6-oxo-1H-pyridine-4-carboxamide (CID 110698671) is N-tert-butyl-2-methyl-6-oxo-1H-pyridine-4-carboxamide.
What is the SMILES notation for N-tert-butyl-2-methyl-6-oxo-1H-pyridine-4-carboxamide?
The canonical SMILES for N-tert-butyl-2-methyl-6-oxo-1H-pyridine-4-carboxamide is Cc1cc(C(=O)NC(C)(C)C)cc(=O)[nH]1.
What is the InChIKey of N-tert-butyl-2-methyl-6-oxo-1H-pyridine-4-carboxamide?
The InChIKey is JEYSDDFGVYNVQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-7-5-8(6-9(14)12-7)10(15)13-11(2,3)4/h5-6H,1-4H3,(H,12,14)(H,13,15).
What are the key properties of N-tert-butyl-2-methyl-6-oxo-1H-pyridine-4-carboxamide?
N-tert-butyl-2-methyl-6-oxo-1H-pyridine-4-carboxamide has a molecular weight of 208.26 g/mol, XLogP of 1.21, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-methyl-6-oxo-1H-pyridine-4-carboxamide is sourced from PubChem (CID 110698671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).