N-[6-(2,2-dimethylpropanoylamino)-2-pyridinyl]-2,2-dimethylpropanamide

C15H23N3O2 — CID 3555177

IUPACN-[6-(2,2-dimethylpropanoylamino)-2-pyridinyl]-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)Nc1cccc(NC(=O)C(C)(C)C)n1
InChIInChI=1S/C15H23N3O2/c1-14(2,3)12(19)17-10-8-7-9-11(16-10)18-13(20)15(4,5)6/h7-9H,1-6H3,(H2,16,17,18,19,20)
InChIKeyVPAGSMLGPQXYME-UHFFFAOYSA-N
MW277.37 g/mol
LogP3.05
Rot. Bonds2

About N-[6-(2,2-dimethylpropanoylamino)-2-pyridinyl]-2,2-dimethylpropanamide

N-[6-(2,2-dimethylpropanoylamino)-2-pyridinyl]-2,2-dimethylpropanamide (PubChem CID 3555177) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-[6-(2,2-dimethylpropanoylamino)-2-pyridinyl]-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-[6-(2,2-dimethylpropanoylamino)-2-pyridinyl]-2,2-dimethylpropanamide
PubChem CID3555177
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC NameN-[6-(2,2-dimethylpropanoylamino)-2-pyridinyl]-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)Nc1cccc(NC(=O)C(C)(C)C)n1
InChIInChI=1S/C15H23N3O2/c1-14(2,3)12(19)17-10-8-7-9-11(16-10)18-13(20)15(4,5)6/h7-9H,1-6H3,(H2,16,17,18,19,20)
InChIKeyVPAGSMLGPQXYME-UHFFFAOYSA-N
XLogP3.05
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 53.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[6-(2,2-dimethylpropanoylamino)-2-pyridinyl]-2,2-dimethylpropanamide?
The IUPAC name of N-[6-(2,2-dimethylpropanoylamino)-2-pyridinyl]-2,2-dimethylpropanamide (CID 3555177) is N-[6-(2,2-dimethylpropanoylamino)-2-pyridinyl]-2,2-dimethylpropanamide.
What is the SMILES notation for N-[6-(2,2-dimethylpropanoylamino)-2-pyridinyl]-2,2-dimethylpropanamide?
The canonical SMILES for N-[6-(2,2-dimethylpropanoylamino)-2-pyridinyl]-2,2-dimethylpropanamide is CC(C)(C)C(=O)Nc1cccc(NC(=O)C(C)(C)C)n1.
What is the InChIKey of N-[6-(2,2-dimethylpropanoylamino)-2-pyridinyl]-2,2-dimethylpropanamide?
The InChIKey is VPAGSMLGPQXYME-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-14(2,3)12(19)17-10-8-7-9-11(16-10)18-13(20)15(4,5)6/h7-9H,1-6H3,(H2,16,17,18,19,20).
What are the key properties of N-[6-(2,2-dimethylpropanoylamino)-2-pyridinyl]-2,2-dimethylpropanamide?
N-[6-(2,2-dimethylpropanoylamino)-2-pyridinyl]-2,2-dimethylpropanamide has a molecular weight of 277.37 g/mol, XLogP of 3.05, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2,2-dimethylpropanoylamino)-2-pyridinyl]-2,2-dimethylpropanamide is sourced from PubChem (CID 3555177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).