N-(2-methoxy-6-methylphenyl)-N-methylbenzamide

C16H17NO2 — CID 68723005

IUPACN-(2-methoxy-6-methylphenyl)-N-methylbenzamide
SMILESCOc1cccc(C)c1N(C)C(=O)c1ccccc1
InChIInChI=1S/C16H17NO2/c1-12-8-7-11-14(19-3)15(12)17(2)16(18)13-9-5-4-6-10-13/h4-11H,1-3H3
InChIKeyYJSUBVKZLLSBTP-UHFFFAOYSA-N
MW255.32 g/mol
LogP3.28
Rot. Bonds3

About N-(2-methoxy-6-methylphenyl)-N-methylbenzamide

N-(2-methoxy-6-methylphenyl)-N-methylbenzamide (PubChem CID 68723005) has the molecular formula C16H17NO2 and a molecular weight of 255.32 g/mol. Its IUPAC name is N-(2-methoxy-6-methylphenyl)-N-methylbenzamide.

Molecular Properties

Compound NameN-(2-methoxy-6-methylphenyl)-N-methylbenzamide
PubChem CID68723005
Molecular FormulaC16H17NO2
Molecular Weight255.32 g/mol
Exact Mass255.13
IUPAC NameN-(2-methoxy-6-methylphenyl)-N-methylbenzamide
SMILESCOc1cccc(C)c1N(C)C(=O)c1ccccc1
InChIInChI=1S/C16H17NO2/c1-12-8-7-11-14(19-3)15(12)17(2)16(18)13-9-5-4-6-10-13/h4-11H,1-3H3
InChIKeyYJSUBVKZLLSBTP-UHFFFAOYSA-N
XLogP3.28
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-6-methylphenyl)-N-methylbenzamide?
The IUPAC name of N-(2-methoxy-6-methylphenyl)-N-methylbenzamide (CID 68723005) is N-(2-methoxy-6-methylphenyl)-N-methylbenzamide.
What is the SMILES notation for N-(2-methoxy-6-methylphenyl)-N-methylbenzamide?
The canonical SMILES for N-(2-methoxy-6-methylphenyl)-N-methylbenzamide is COc1cccc(C)c1N(C)C(=O)c1ccccc1.
What is the InChIKey of N-(2-methoxy-6-methylphenyl)-N-methylbenzamide?
The InChIKey is YJSUBVKZLLSBTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO2/c1-12-8-7-11-14(19-3)15(12)17(2)16(18)13-9-5-4-6-10-13/h4-11H,1-3H3.
What are the key properties of N-(2-methoxy-6-methylphenyl)-N-methylbenzamide?
N-(2-methoxy-6-methylphenyl)-N-methylbenzamide has a molecular weight of 255.32 g/mol, XLogP of 3.28, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-6-methylphenyl)-N-methylbenzamide is sourced from PubChem (CID 68723005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).