2-methoxy-4,5-dimethyl-N-pyridin-2-ylbenzamide

C15H16N2O2 — CID 110761563

IUPAC2-methoxy-4,5-dimethyl-N-pyridin-2-ylbenzamide
SMILESCOc1cc(C)c(C)cc1C(=O)Nc1ccccn1
InChIInChI=1S/C15H16N2O2/c1-10-8-12(13(19-3)9-11(10)2)15(18)17-14-6-4-5-7-16-14/h4-9H,1-3H3,(H,16,17,18)
InChIKeyHLZWUYZZQRTOBW-UHFFFAOYSA-N
MW256.31 g/mol
LogP2.96
Rot. Bonds3

About 2-methoxy-4,5-dimethyl-N-pyridin-2-ylbenzamide

2-methoxy-4,5-dimethyl-N-pyridin-2-ylbenzamide (PubChem CID 110761563) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is 2-methoxy-4,5-dimethyl-N-pyridin-2-ylbenzamide.

Molecular Properties

Compound Name2-methoxy-4,5-dimethyl-N-pyridin-2-ylbenzamide
PubChem CID110761563
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC Name2-methoxy-4,5-dimethyl-N-pyridin-2-ylbenzamide
SMILESCOc1cc(C)c(C)cc1C(=O)Nc1ccccn1
InChIInChI=1S/C15H16N2O2/c1-10-8-12(13(19-3)9-11(10)2)15(18)17-14-6-4-5-7-16-14/h4-9H,1-3H3,(H,16,17,18)
InChIKeyHLZWUYZZQRTOBW-UHFFFAOYSA-N
XLogP2.96
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-4,5-dimethyl-N-pyridin-2-ylbenzamide?
The IUPAC name of 2-methoxy-4,5-dimethyl-N-pyridin-2-ylbenzamide (CID 110761563) is 2-methoxy-4,5-dimethyl-N-pyridin-2-ylbenzamide.
What is the SMILES notation for 2-methoxy-4,5-dimethyl-N-pyridin-2-ylbenzamide?
The canonical SMILES for 2-methoxy-4,5-dimethyl-N-pyridin-2-ylbenzamide is COc1cc(C)c(C)cc1C(=O)Nc1ccccn1.
What is the InChIKey of 2-methoxy-4,5-dimethyl-N-pyridin-2-ylbenzamide?
The InChIKey is HLZWUYZZQRTOBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-10-8-12(13(19-3)9-11(10)2)15(18)17-14-6-4-5-7-16-14/h4-9H,1-3H3,(H,16,17,18).
What are the key properties of 2-methoxy-4,5-dimethyl-N-pyridin-2-ylbenzamide?
2-methoxy-4,5-dimethyl-N-pyridin-2-ylbenzamide has a molecular weight of 256.31 g/mol, XLogP of 2.96, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4,5-dimethyl-N-pyridin-2-ylbenzamide is sourced from PubChem (CID 110761563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).