2-(4,6-dimethyl-3-pyridinyl)-N,N-dimethylacetamide

C11H16N2O — CID 142686541

IUPAC2-(4,6-dimethyl-3-pyridinyl)-N,N-dimethylacetamide
SMILESCc1cc(C)c(CC(=O)N(C)C)cn1
InChIInChI=1S/C11H16N2O/c1-8-5-9(2)12-7-10(8)6-11(14)13(3)4/h5,7H,6H2,1-4H3
InChIKeyZOUOPQBUJRUFGA-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.33
Rot. Bonds2

About 2-(4,6-dimethyl-3-pyridinyl)-N,N-dimethylacetamide

2-(4,6-dimethyl-3-pyridinyl)-N,N-dimethylacetamide (PubChem CID 142686541) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 2-(4,6-dimethyl-3-pyridinyl)-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-(4,6-dimethyl-3-pyridinyl)-N,N-dimethylacetamide
PubChem CID142686541
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name2-(4,6-dimethyl-3-pyridinyl)-N,N-dimethylacetamide
SMILESCc1cc(C)c(CC(=O)N(C)C)cn1
InChIInChI=1S/C11H16N2O/c1-8-5-9(2)12-7-10(8)6-11(14)13(3)4/h5,7H,6H2,1-4H3
InChIKeyZOUOPQBUJRUFGA-UHFFFAOYSA-N
XLogP1.33
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4,6-dimethyl-3-pyridinyl)-N,N-dimethylacetamide?
The IUPAC name of 2-(4,6-dimethyl-3-pyridinyl)-N,N-dimethylacetamide (CID 142686541) is 2-(4,6-dimethyl-3-pyridinyl)-N,N-dimethylacetamide.
What is the SMILES notation for 2-(4,6-dimethyl-3-pyridinyl)-N,N-dimethylacetamide?
The canonical SMILES for 2-(4,6-dimethyl-3-pyridinyl)-N,N-dimethylacetamide is Cc1cc(C)c(CC(=O)N(C)C)cn1.
What is the InChIKey of 2-(4,6-dimethyl-3-pyridinyl)-N,N-dimethylacetamide?
The InChIKey is ZOUOPQBUJRUFGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-8-5-9(2)12-7-10(8)6-11(14)13(3)4/h5,7H,6H2,1-4H3.
What are the key properties of 2-(4,6-dimethyl-3-pyridinyl)-N,N-dimethylacetamide?
2-(4,6-dimethyl-3-pyridinyl)-N,N-dimethylacetamide has a molecular weight of 192.26 g/mol, XLogP of 1.33, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,6-dimethyl-3-pyridinyl)-N,N-dimethylacetamide is sourced from PubChem (CID 142686541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).