N-[6-(2,3-dimethylphenyl)-4-(methylamino)-2-pyridinyl]acetamide

C16H19N3O — CID 155527650

IUPACN-[6-(2,3-dimethylphenyl)-4-(methylamino)-2-pyridinyl]acetamide
SMILESCNc1cc(NC(C)=O)nc(-c2cccc(C)c2C)c1
InChIInChI=1S/C16H19N3O/c1-10-6-5-7-14(11(10)2)15-8-13(17-4)9-16(19-15)18-12(3)20/h5-9H,1-4H3,(H2,17,18,19,20)
InChIKeyBOOFLAUEYOEJMP-UHFFFAOYSA-N
MW269.35 g/mol
LogP3.37
Rot. Bonds3

About N-[6-(2,3-dimethylphenyl)-4-(methylamino)-2-pyridinyl]acetamide

N-[6-(2,3-dimethylphenyl)-4-(methylamino)-2-pyridinyl]acetamide (PubChem CID 155527650) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is N-[6-(2,3-dimethylphenyl)-4-(methylamino)-2-pyridinyl]acetamide.

Molecular Properties

Compound NameN-[6-(2,3-dimethylphenyl)-4-(methylamino)-2-pyridinyl]acetamide
PubChem CID155527650
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC NameN-[6-(2,3-dimethylphenyl)-4-(methylamino)-2-pyridinyl]acetamide
SMILESCNc1cc(NC(C)=O)nc(-c2cccc(C)c2C)c1
InChIInChI=1S/C16H19N3O/c1-10-6-5-7-14(11(10)2)15-8-13(17-4)9-16(19-15)18-12(3)20/h5-9H,1-4H3,(H2,17,18,19,20)
InChIKeyBOOFLAUEYOEJMP-UHFFFAOYSA-N
XLogP3.37
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 53.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[6-(2,3-dimethylphenyl)-4-(methylamino)-2-pyridinyl]acetamide?
The IUPAC name of N-[6-(2,3-dimethylphenyl)-4-(methylamino)-2-pyridinyl]acetamide (CID 155527650) is N-[6-(2,3-dimethylphenyl)-4-(methylamino)-2-pyridinyl]acetamide.
What is the SMILES notation for N-[6-(2,3-dimethylphenyl)-4-(methylamino)-2-pyridinyl]acetamide?
The canonical SMILES for N-[6-(2,3-dimethylphenyl)-4-(methylamino)-2-pyridinyl]acetamide is CNc1cc(NC(C)=O)nc(-c2cccc(C)c2C)c1.
What is the InChIKey of N-[6-(2,3-dimethylphenyl)-4-(methylamino)-2-pyridinyl]acetamide?
The InChIKey is BOOFLAUEYOEJMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-10-6-5-7-14(11(10)2)15-8-13(17-4)9-16(19-15)18-12(3)20/h5-9H,1-4H3,(H2,17,18,19,20).
What are the key properties of N-[6-(2,3-dimethylphenyl)-4-(methylamino)-2-pyridinyl]acetamide?
N-[6-(2,3-dimethylphenyl)-4-(methylamino)-2-pyridinyl]acetamide has a molecular weight of 269.35 g/mol, XLogP of 3.37, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2,3-dimethylphenyl)-4-(methylamino)-2-pyridinyl]acetamide is sourced from PubChem (CID 155527650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).