2-methoxy-3-methyl-N-(2-propan-2-ylphenyl)benzamide

C18H21NO2 — CID 17101838

IUPAC2-methoxy-3-methyl-N-(2-propan-2-ylphenyl)benzamide
SMILESCOc1c(C)cccc1C(=O)Nc1ccccc1C(C)C
InChIInChI=1S/C18H21NO2/c1-12(2)14-9-5-6-11-16(14)19-18(20)15-10-7-8-13(3)17(15)21-4/h5-12H,1-4H3,(H,19,20)
InChIKeyCXHBPTYDLKZNLM-UHFFFAOYSA-N
MW283.37 g/mol
LogP4.38
Rot. Bonds4

About 2-methoxy-3-methyl-N-(2-propan-2-ylphenyl)benzamide

2-methoxy-3-methyl-N-(2-propan-2-ylphenyl)benzamide (PubChem CID 17101838) has the molecular formula C18H21NO2 and a molecular weight of 283.37 g/mol. Its IUPAC name is 2-methoxy-3-methyl-N-(2-propan-2-ylphenyl)benzamide.

Molecular Properties

Compound Name2-methoxy-3-methyl-N-(2-propan-2-ylphenyl)benzamide
PubChem CID17101838
Molecular FormulaC18H21NO2
Molecular Weight283.37 g/mol
Exact Mass283.16
IUPAC Name2-methoxy-3-methyl-N-(2-propan-2-ylphenyl)benzamide
SMILESCOc1c(C)cccc1C(=O)Nc1ccccc1C(C)C
InChIInChI=1S/C18H21NO2/c1-12(2)14-9-5-6-11-16(14)19-18(20)15-10-7-8-13(3)17(15)21-4/h5-12H,1-4H3,(H,19,20)
InChIKeyCXHBPTYDLKZNLM-UHFFFAOYSA-N
XLogP4.38
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methoxy-3-methyl-N-[(2-propan-2-ylphenyl)carbamothioyl]benzamide
CID 17099552
N-[(2-butan-2-ylphenyl)carbamothioyl]-2-methoxy-3-methylbenzamide
CID 17100406
2-iodo-N-(2-propan-2-ylphenyl)benzamide
CID 615900
[2-[(2-propan-2-ylphenyl)carbamoyl]phenyl] acetate
CID 720313
3-(methanesulfonamido)-2-methyl-N-(2-propan-2-ylphenyl)benzamide
CID 41448887
N-(2-propan-2-ylphenyl)-5,6,7,8-tetrahydronaphthalene-1-carboxamide
CID 98001091
2-amino-4-methoxy-N-(2-propan-2-ylphenyl)benzamide
CID 80503097
N-[(2-iodophenyl)carbamothioyl]-2-methoxy-3-methylbenzamide
CID 1259324
2-fluoro-4-methoxy-N-(2-propan-2-ylphenyl)benzamide
CID 103602982
1-(2,3-dimethylphenyl)-3-(2-propan-2-ylphenyl)urea
CID 108991425
4,5,6-trimethoxy-N-(2-propan-2-ylphenyl)-1H-indole-3-carboxamide
CID 113206791
methyl 2-[(2-propan-2-ylphenyl)carbamoylamino]benzoate
CID 22301794

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-3-methyl-N-(2-propan-2-ylphenyl)benzamide?
The IUPAC name of 2-methoxy-3-methyl-N-(2-propan-2-ylphenyl)benzamide (CID 17101838) is 2-methoxy-3-methyl-N-(2-propan-2-ylphenyl)benzamide.
What is the SMILES notation for 2-methoxy-3-methyl-N-(2-propan-2-ylphenyl)benzamide?
The canonical SMILES for 2-methoxy-3-methyl-N-(2-propan-2-ylphenyl)benzamide is COc1c(C)cccc1C(=O)Nc1ccccc1C(C)C.
What is the InChIKey of 2-methoxy-3-methyl-N-(2-propan-2-ylphenyl)benzamide?
The InChIKey is CXHBPTYDLKZNLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO2/c1-12(2)14-9-5-6-11-16(14)19-18(20)15-10-7-8-13(3)17(15)21-4/h5-12H,1-4H3,(H,19,20).
What are the key properties of 2-methoxy-3-methyl-N-(2-propan-2-ylphenyl)benzamide?
2-methoxy-3-methyl-N-(2-propan-2-ylphenyl)benzamide has a molecular weight of 283.37 g/mol, XLogP of 4.38, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-3-methyl-N-(2-propan-2-ylphenyl)benzamide is sourced from PubChem (CID 17101838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).