N-(1-methoxy-2-methylpropan-2-yl)-2-methyl-6-oxo-1H-pyridine-4-carboxamide

C12H18N2O3 — CID 122569893

IUPACN-(1-methoxy-2-methylpropan-2-yl)-2-methyl-6-oxo-1H-pyridine-4-carboxamide
SMILESCOCC(C)(C)NC(=O)c1cc(C)[nH]c(=O)c1
InChIInChI=1S/C12H18N2O3/c1-8-5-9(6-10(15)13-8)11(16)14-12(2,3)7-17-4/h5-6H,7H2,1-4H3,(H,13,15)(H,14,16)
InChIKeyNYAXEBNTICVUSF-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.84
Rot. Bonds4

About N-(1-methoxy-2-methylpropan-2-yl)-2-methyl-6-oxo-1H-pyridine-4-carboxamide

N-(1-methoxy-2-methylpropan-2-yl)-2-methyl-6-oxo-1H-pyridine-4-carboxamide (PubChem CID 122569893) has the molecular formula C12H18N2O3 and a molecular weight of 238.29 g/mol. Its IUPAC name is N-(1-methoxy-2-methylpropan-2-yl)-2-methyl-6-oxo-1H-pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(1-methoxy-2-methylpropan-2-yl)-2-methyl-6-oxo-1H-pyridine-4-carboxamide
PubChem CID122569893
Molecular FormulaC12H18N2O3
Molecular Weight238.29 g/mol
Exact Mass238.13
IUPAC NameN-(1-methoxy-2-methylpropan-2-yl)-2-methyl-6-oxo-1H-pyridine-4-carboxamide
SMILESCOCC(C)(C)NC(=O)c1cc(C)[nH]c(=O)c1
InChIInChI=1S/C12H18N2O3/c1-8-5-9(6-10(15)13-8)11(16)14-12(2,3)7-17-4/h5-6H,7H2,1-4H3,(H,13,15)(H,14,16)
InChIKeyNYAXEBNTICVUSF-UHFFFAOYSA-N
XLogP0.84
TPSA71.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-tert-butyl-2-methyl-6-oxo-1H-pyridine-4-carboxamide
CID 110698671
N,2-dimethyl-6-oxo-1H-pyridine-4-carboxamide
CID 59355711
N-(1-methoxy-2-methylpropan-2-yl)-2,3-dimethyl-1H-indole-5-carboxamide
CID 115606615
N-[1-[(4-amino-2,2-dioxo-1H-2λ6,3-benzothiazin-5-yl)oxy]-2-methylpropan-2-yl]-2-methyl-6-oxo-1H-pyridine-4-carboxamide
CID 147276301
N-(1-hydroxy-2-methylpropan-2-yl)-2-(2-methylpropyl)-6-oxo-1H-pyridine-4-carboxamide
CID 110000936
4-methoxy-3-methyl-3-[[2-(2-methylpropyl)-6-oxo-1H-pyridine-4-carbonyl]amino]butanoic acid
CID 120532376
N-butan-2-yl-2-methyl-6-oxo-1H-pyridine-4-carboxamide
CID 110698591
3-chloro-5-[(1-methoxy-2-methylpropan-2-yl)carbamoyl]benzenesulfonyl chloride
CID 113470451
3-chloro-4-hydroxy-N-(1-methoxy-2-methylpropan-2-yl)benzamide
CID 113470520
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
2-methyl-6-oxo-1H-pyridine-4-carboxamide
CID 68620934

Frequently Asked Questions

What is the IUPAC name of N-(1-methoxy-2-methylpropan-2-yl)-2-methyl-6-oxo-1H-pyridine-4-carboxamide?
The IUPAC name of N-(1-methoxy-2-methylpropan-2-yl)-2-methyl-6-oxo-1H-pyridine-4-carboxamide (CID 122569893) is N-(1-methoxy-2-methylpropan-2-yl)-2-methyl-6-oxo-1H-pyridine-4-carboxamide.
What is the SMILES notation for N-(1-methoxy-2-methylpropan-2-yl)-2-methyl-6-oxo-1H-pyridine-4-carboxamide?
The canonical SMILES for N-(1-methoxy-2-methylpropan-2-yl)-2-methyl-6-oxo-1H-pyridine-4-carboxamide is COCC(C)(C)NC(=O)c1cc(C)[nH]c(=O)c1.
What is the InChIKey of N-(1-methoxy-2-methylpropan-2-yl)-2-methyl-6-oxo-1H-pyridine-4-carboxamide?
The InChIKey is NYAXEBNTICVUSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O3/c1-8-5-9(6-10(15)13-8)11(16)14-12(2,3)7-17-4/h5-6H,7H2,1-4H3,(H,13,15)(H,14,16).
What are the key properties of N-(1-methoxy-2-methylpropan-2-yl)-2-methyl-6-oxo-1H-pyridine-4-carboxamide?
N-(1-methoxy-2-methylpropan-2-yl)-2-methyl-6-oxo-1H-pyridine-4-carboxamide has a molecular weight of 238.29 g/mol, XLogP of 0.84, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methoxy-2-methylpropan-2-yl)-2-methyl-6-oxo-1H-pyridine-4-carboxamide is sourced from PubChem (CID 122569893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).