2,6-dimethyl-N-pyridin-2-ylbenzamide

C14H14N2O — CID 118707938

IUPAC2,6-dimethyl-N-pyridin-2-ylbenzamide
SMILESCc1cccc(C)c1C(=O)Nc1ccccn1
InChIInChI=1S/C14H14N2O/c1-10-6-5-7-11(2)13(10)14(17)16-12-8-3-4-9-15-12/h3-9H,1-2H3,(H,15,16,17)
InChIKeyWPAJLQAGXSKSJN-UHFFFAOYSA-N
MW226.28 g/mol
LogP2.95
Rot. Bonds2

About 2,6-dimethyl-N-pyridin-2-ylbenzamide

2,6-dimethyl-N-pyridin-2-ylbenzamide (PubChem CID 118707938) has the molecular formula C14H14N2O and a molecular weight of 226.28 g/mol. Its IUPAC name is 2,6-dimethyl-N-pyridin-2-ylbenzamide.

Molecular Properties

Compound Name2,6-dimethyl-N-pyridin-2-ylbenzamide
PubChem CID118707938
Molecular FormulaC14H14N2O
Molecular Weight226.28 g/mol
Exact Mass226.11
IUPAC Name2,6-dimethyl-N-pyridin-2-ylbenzamide
SMILESCc1cccc(C)c1C(=O)Nc1ccccn1
InChIInChI=1S/C14H14N2O/c1-10-6-5-7-11(2)13(10)14(17)16-12-8-3-4-9-15-12/h3-9H,1-2H3,(H,15,16,17)
InChIKeyWPAJLQAGXSKSJN-UHFFFAOYSA-N
XLogP2.95
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-N-pyridin-2-ylbenzamide?
The IUPAC name of 2,6-dimethyl-N-pyridin-2-ylbenzamide (CID 118707938) is 2,6-dimethyl-N-pyridin-2-ylbenzamide.
What is the SMILES notation for 2,6-dimethyl-N-pyridin-2-ylbenzamide?
The canonical SMILES for 2,6-dimethyl-N-pyridin-2-ylbenzamide is Cc1cccc(C)c1C(=O)Nc1ccccn1.
What is the InChIKey of 2,6-dimethyl-N-pyridin-2-ylbenzamide?
The InChIKey is WPAJLQAGXSKSJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O/c1-10-6-5-7-11(2)13(10)14(17)16-12-8-3-4-9-15-12/h3-9H,1-2H3,(H,15,16,17).
What are the key properties of 2,6-dimethyl-N-pyridin-2-ylbenzamide?
2,6-dimethyl-N-pyridin-2-ylbenzamide has a molecular weight of 226.28 g/mol, XLogP of 2.95, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-N-pyridin-2-ylbenzamide is sourced from PubChem (CID 118707938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).