N-tert-butyl-2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carboxamide

C11H16N2O3 — CID 136622509

IUPACN-tert-butyl-2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carboxamide
SMILESCc1cc(=O)[nH]c(O)c1C(=O)NC(C)(C)C
InChIInChI=1S/C11H16N2O3/c1-6-5-7(14)12-9(15)8(6)10(16)13-11(2,3)4/h5H,1-4H3,(H,13,16)(H2,12,14,15)
InChIKeyUXEFBUMUXZBMNO-UHFFFAOYSA-N
MW224.26 g/mol
LogP0.92
Rot. Bonds1

About N-tert-butyl-2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carboxamide

N-tert-butyl-2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carboxamide (PubChem CID 136622509) has the molecular formula C11H16N2O3 and a molecular weight of 224.26 g/mol. Its IUPAC name is N-tert-butyl-2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-tert-butyl-2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carboxamide
PubChem CID136622509
Molecular FormulaC11H16N2O3
Molecular Weight224.26 g/mol
Exact Mass224.12
IUPAC NameN-tert-butyl-2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carboxamide
SMILESCc1cc(=O)[nH]c(O)c1C(=O)NC(C)(C)C
InChIInChI=1S/C11H16N2O3/c1-6-5-7(14)12-9(15)8(6)10(16)13-11(2,3)4/h5H,1-4H3,(H,13,16)(H2,12,14,15)
InChIKeyUXEFBUMUXZBMNO-UHFFFAOYSA-N
XLogP0.92
TPSA82.19 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 50.92
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2,4-Dimethyl-6-oxo-1,6-dihydropyridine-3-carboxamide
CID 3446569
1,2-Dihydro-6-hydroxy-4-methyl-2-oxo-3-pyridinecarboxamide
CID 4460172
2-hydroxy-4,5-dimethyl-6-oxo-1H-pyridine-3-carboxamide
CID 135733679
N,N-diethyl-2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carboxamide
CID 135840410
N-ethyl-2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carboxamide
CID 136126066
N-butyl-2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carboxamide
CID 136429177
5-ethyl-2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carboxamide
CID 136442646
Sodium (tert-butylamino)-[2-(tert-butylcarbamoyl)cyclopenta-2,4-dien-1-ylidene]methanolate
CID 139905838
Lithium (tert-butylamino)-[2-(tert-butylcarbamoyl)cyclopenta-2,4-dien-1-ylidene]methanolate
CID 139905855
2-hydroxy-N,4-dimethyl-6-oxo-1H-pyridine-3-carboxamide
CID 141392764
(E)-N-[(2E,4Z)-hepta-2,4-dien-2-yl]-3-hydroxy-2-prop-1-en-2-ylbut-2-enamide
CID 145564053
N-(3-Ethyl-6-methyl-2-oxo-1,2-dihydropyridin-4-yl)butanamide
CID 13146820

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-tert-butyl-2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carboxamide (CID 136622509) is N-tert-butyl-2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-tert-butyl-2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-tert-butyl-2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carboxamide is Cc1cc(=O)[nH]c(O)c1C(=O)NC(C)(C)C.
What is the InChIKey of N-tert-butyl-2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carboxamide?
The InChIKey is UXEFBUMUXZBMNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O3/c1-6-5-7(14)12-9(15)8(6)10(16)13-11(2,3)4/h5H,1-4H3,(H,13,16)(H2,12,14,15).
What are the key properties of N-tert-butyl-2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carboxamide?
N-tert-butyl-2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carboxamide has a molecular weight of 224.26 g/mol, XLogP of 0.92, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 136622509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).