6-methyl-N-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide

C11H16N2O2 — CID 82723958

IUPAC6-methyl-N-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide
SMILESCc1ccc(C(=O)NOC(C)(C)C)cn1
InChIInChI=1S/C11H16N2O2/c1-8-5-6-9(7-12-8)10(14)13-15-11(2,3)4/h5-7H,1-4H3,(H,13,14)
InChIKeyDTHNIUSSMRHQAA-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.85
Rot. Bonds2

About 6-methyl-N-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide

6-methyl-N-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide (PubChem CID 82723958) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 6-methyl-N-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-methyl-N-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide
PubChem CID82723958
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name6-methyl-N-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide
SMILESCc1ccc(C(=O)NOC(C)(C)C)cn1
InChIInChI=1S/C11H16N2O2/c1-8-5-6-9(7-12-8)10(14)13-15-11(2,3)4/h5-7H,1-4H3,(H,13,14)
InChIKeyDTHNIUSSMRHQAA-UHFFFAOYSA-N
XLogP1.85
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

6-methyl-N-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide
CID 81340039
6-methyl-N-phenylmethoxypyridine-3-carboxamide
CID 18149129
N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-6-methylpyridine-3-carboxamide
CID 107846996
6-methyl-N-[2-(methylamino)ethyl]pyridine-3-carboxamide
CID 62657976
3-amino-4-methyl-N-[(2-methylpropan-2-yl)oxy]benzamide
CID 82724682
N'-(4-ethoxybenzoyl)-6-methylpyridine-3-carbohydrazide
CID 18147998
2,2-dimethyl-3-[(6-methylpyridine-3-carbonyl)amino]propanoic acid
CID 81367392
6-methyl-N-[3-[(6-methylpyridine-3-carbonyl)amino]propyl]pyridine-3-carboxamide
CID 3159007
N-(1-amino-2-cyclopropylpropan-2-yl)-6-methylpyridine-3-carboxamide
CID 81487644
6-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide
CID 10013611
N-(2-amino-2-ethylbutyl)-6-methylpyridine-3-carboxamide;dihydrochloride
CID 119641996
N-(1-cyanoethyl)-6-methylpyridine-3-carboxamide
CID 61121839

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide?
The IUPAC name of 6-methyl-N-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide (CID 82723958) is 6-methyl-N-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide.
What is the SMILES notation for 6-methyl-N-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide?
The canonical SMILES for 6-methyl-N-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide is Cc1ccc(C(=O)NOC(C)(C)C)cn1.
What is the InChIKey of 6-methyl-N-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide?
The InChIKey is DTHNIUSSMRHQAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-8-5-6-9(7-12-8)10(14)13-15-11(2,3)4/h5-7H,1-4H3,(H,13,14).
What are the key properties of 6-methyl-N-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide?
6-methyl-N-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide has a molecular weight of 208.26 g/mol, XLogP of 1.85, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide is sourced from PubChem (CID 82723958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).