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

C16H17NO2 — CID 60636386

IUPAC3-hydroxy-N-methyl-N-[(2-methylphenyl)methyl]benzamide
SMILESCc1ccccc1CN(C)C(=O)c1cccc(O)c1
InChIInChI=1S/C16H17NO2/c1-12-6-3-4-7-14(12)11-17(2)16(19)13-8-5-9-15(18)10-13/h3-10,18H,11H2,1-2H3
InChIKeyWCGMCGRKIMMPST-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.97
Rot. Bonds3

About 3-hydroxy-N-methyl-N-[(2-methylphenyl)methyl]benzamide

3-hydroxy-N-methyl-N-[(2-methylphenyl)methyl]benzamide (PubChem CID 60636386) has the molecular formula C16H17NO2 and a molecular weight of 255.32 g/mol. Its IUPAC name is 3-hydroxy-N-methyl-N-[(2-methylphenyl)methyl]benzamide.

Molecular Properties

Compound Name3-hydroxy-N-methyl-N-[(2-methylphenyl)methyl]benzamide
PubChem CID60636386
Molecular FormulaC16H17NO2
Molecular Weight255.32 g/mol
Exact Mass255.13
IUPAC Name3-hydroxy-N-methyl-N-[(2-methylphenyl)methyl]benzamide
SMILESCc1ccccc1CN(C)C(=O)c1cccc(O)c1
InChIInChI=1S/C16H17NO2/c1-12-6-3-4-7-14(12)11-17(2)16(19)13-8-5-9-15(18)10-13/h3-10,18H,11H2,1-2H3
InChIKeyWCGMCGRKIMMPST-UHFFFAOYSA-N
XLogP2.97
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-hydroxy-N-methyl-N-[(2-methylphenyl)methyl]benzamide
CID 60631099
4-fluoro-N,3-dimethyl-N-[(2-methylphenyl)methyl]benzamide
CID 63213046
N-methyl-N-[(2-methylphenyl)methyl]thiophene-3-carboxamide
CID 78803856
3-amino-4-bromo-N-methyl-N-[(2-methylphenyl)methyl]benzamide
CID 61094065
N-[(2-hydroxyphenyl)methyl]-3-iodo-N-methylbenzamide
CID 47290646
4-methoxy-N-methyl-N-[(2-methylphenyl)methyl]benzamide
CID 134028521
methyl 4-[methyl-[(2-methylphenyl)methyl]carbamoyl]benzoate
CID 9368938
3-amino-N-[(2-hydroxyphenyl)methyl]-N-methylbenzamide
CID 54906216
4-amino-3-methoxy-N-methyl-N-[(2-methylphenyl)methyl]benzamide
CID 104782446
3-amino-4-methoxy-N-methyl-N-[(2-methylphenyl)methyl]benzamide
CID 43574048
N,2,4-trimethyl-N-[(2-methylphenyl)methyl]benzamide
CID 134028537
N-[[2-(aminomethyl)phenyl]methyl]-N,3-dimethylbenzamide
CID 60923258

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-methyl-N-[(2-methylphenyl)methyl]benzamide?
The IUPAC name of 3-hydroxy-N-methyl-N-[(2-methylphenyl)methyl]benzamide (CID 60636386) is 3-hydroxy-N-methyl-N-[(2-methylphenyl)methyl]benzamide.
What is the SMILES notation for 3-hydroxy-N-methyl-N-[(2-methylphenyl)methyl]benzamide?
The canonical SMILES for 3-hydroxy-N-methyl-N-[(2-methylphenyl)methyl]benzamide is Cc1ccccc1CN(C)C(=O)c1cccc(O)c1.
What is the InChIKey of 3-hydroxy-N-methyl-N-[(2-methylphenyl)methyl]benzamide?
The InChIKey is WCGMCGRKIMMPST-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO2/c1-12-6-3-4-7-14(12)11-17(2)16(19)13-8-5-9-15(18)10-13/h3-10,18H,11H2,1-2H3.
What are the key properties of 3-hydroxy-N-methyl-N-[(2-methylphenyl)methyl]benzamide?
3-hydroxy-N-methyl-N-[(2-methylphenyl)methyl]benzamide has a molecular weight of 255.32 g/mol, XLogP of 2.97, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-methyl-N-[(2-methylphenyl)methyl]benzamide is sourced from PubChem (CID 60636386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).