2-methyl-N-[(2-methylphenyl)methyl]benzamide

C16H17NO — CID 881366

IUPAC2-methyl-N-[(2-methylphenyl)methyl]benzamide
SMILESCc1ccccc1CNC(=O)c1ccccc1C
InChIInChI=1S/C16H17NO/c1-12-7-3-5-9-14(12)11-17-16(18)15-10-6-4-8-13(15)2/h3-10H,11H2,1-2H3,(H,17,18)
InChIKeyBSWPHVDHTRMPNC-UHFFFAOYSA-N
MW239.32 g/mol
LogP3.23
Rot. Bonds3

About 2-methyl-N-[(2-methylphenyl)methyl]benzamide

2-methyl-N-[(2-methylphenyl)methyl]benzamide (PubChem CID 881366) has the molecular formula C16H17NO and a molecular weight of 239.32 g/mol. Its IUPAC name is 2-methyl-N-[(2-methylphenyl)methyl]benzamide.

Molecular Properties

Compound Name2-methyl-N-[(2-methylphenyl)methyl]benzamide
PubChem CID881366
Molecular FormulaC16H17NO
Molecular Weight239.32 g/mol
Exact Mass239.13
IUPAC Name2-methyl-N-[(2-methylphenyl)methyl]benzamide
SMILESCc1ccccc1CNC(=O)c1ccccc1C
InChIInChI=1S/C16H17NO/c1-12-7-3-5-9-14(12)11-17-16(18)15-10-6-4-8-13(15)2/h3-10H,11H2,1-2H3,(H,17,18)
InChIKeyBSWPHVDHTRMPNC-UHFFFAOYSA-N
XLogP3.23
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(2-methylphenyl)methyl]benzamide?
The IUPAC name of 2-methyl-N-[(2-methylphenyl)methyl]benzamide (CID 881366) is 2-methyl-N-[(2-methylphenyl)methyl]benzamide.
What is the SMILES notation for 2-methyl-N-[(2-methylphenyl)methyl]benzamide?
The canonical SMILES for 2-methyl-N-[(2-methylphenyl)methyl]benzamide is Cc1ccccc1CNC(=O)c1ccccc1C.
What is the InChIKey of 2-methyl-N-[(2-methylphenyl)methyl]benzamide?
The InChIKey is BSWPHVDHTRMPNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO/c1-12-7-3-5-9-14(12)11-17-16(18)15-10-6-4-8-13(15)2/h3-10H,11H2,1-2H3,(H,17,18).
What are the key properties of 2-methyl-N-[(2-methylphenyl)methyl]benzamide?
2-methyl-N-[(2-methylphenyl)methyl]benzamide has a molecular weight of 239.32 g/mol, XLogP of 3.23, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(2-methylphenyl)methyl]benzamide is sourced from PubChem (CID 881366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).