N-tert-butyl-6-(dimethylamino)pyridine-2-carboxamide

C12H19N3O — CID 84575074

IUPACN-tert-butyl-6-(dimethylamino)pyridine-2-carboxamide
SMILESCN(C)c1cccc(C(=O)NC(C)(C)C)n1
InChIInChI=1S/C12H19N3O/c1-12(2,3)14-11(16)9-7-6-8-10(13-9)15(4)5/h6-8H,1-5H3,(H,14,16)
InChIKeyRWPBKMJVIUPJOP-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.68
Rot. Bonds2

About N-tert-butyl-6-(dimethylamino)pyridine-2-carboxamide

N-tert-butyl-6-(dimethylamino)pyridine-2-carboxamide (PubChem CID 84575074) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is N-tert-butyl-6-(dimethylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-tert-butyl-6-(dimethylamino)pyridine-2-carboxamide
PubChem CID84575074
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC NameN-tert-butyl-6-(dimethylamino)pyridine-2-carboxamide
SMILESCN(C)c1cccc(C(=O)NC(C)(C)C)n1
InChIInChI=1S/C12H19N3O/c1-12(2,3)14-11(16)9-7-6-8-10(13-9)15(4)5/h6-8H,1-5H3,(H,14,16)
InChIKeyRWPBKMJVIUPJOP-UHFFFAOYSA-N
XLogP1.68
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(tert-butylcarbamoyl)pyridine-2-carboxylic acid
CID 43558262
6-(dimethylamino)pyridine-2-carboxylic acid
CID 53408411
6-(dimethylamino)-N-(1-phenylethyl)pyridine-2-carboxamide
CID 84575144
6-(dimethylamino)-N-[2-(dimethylamino)ethyl]pyridine-2-carboxamide
CID 84575014
6-(dimethylamino)-N-(2,4-dimethylphenyl)pyridine-2-carboxamide
CID 84575312
N-[(2-chlorophenyl)methyl]-6-(dimethylamino)pyridine-2-carboxamide
CID 84575011
3-N,6-N-ditert-butylpyridazine-3,6-dicarboxamide
CID 139234600
6-N-tert-butyl-2-N-(pyridin-4-ylmethyl)pyridine-2,6-dicarboxamide
CID 109098333
N-tert-butyl-6-(morpholine-4-carbonyl)pyridine-2-carboxamide
CID 109096027
6-(dimethylamino)pyridine-2-carbothioamide
CID 64587455
6-N-tert-butyl-2-N-[(2-chlorophenyl)methyl]pyridine-2,6-dicarboxamide
CID 109097887
1-N,2-N,3-N-tritert-butylbenzene-1,2,3-tricarboxamide
CID 141065547

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-6-(dimethylamino)pyridine-2-carboxamide?
The IUPAC name of N-tert-butyl-6-(dimethylamino)pyridine-2-carboxamide (CID 84575074) is N-tert-butyl-6-(dimethylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-tert-butyl-6-(dimethylamino)pyridine-2-carboxamide?
The canonical SMILES for N-tert-butyl-6-(dimethylamino)pyridine-2-carboxamide is CN(C)c1cccc(C(=O)NC(C)(C)C)n1.
What is the InChIKey of N-tert-butyl-6-(dimethylamino)pyridine-2-carboxamide?
The InChIKey is RWPBKMJVIUPJOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-12(2,3)14-11(16)9-7-6-8-10(13-9)15(4)5/h6-8H,1-5H3,(H,14,16).
What are the key properties of N-tert-butyl-6-(dimethylamino)pyridine-2-carboxamide?
N-tert-butyl-6-(dimethylamino)pyridine-2-carboxamide has a molecular weight of 221.30 g/mol, XLogP of 1.68, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-6-(dimethylamino)pyridine-2-carboxamide is sourced from PubChem (CID 84575074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).