2-[(3-methylphenyl)methoxy]-N-propan-2-ylbenzamide

C18H21NO2 — CID 18160109

IUPAC2-[(3-methylphenyl)methoxy]-N-propan-2-ylbenzamide
SMILESCc1cccc(COc2ccccc2C(=O)NC(C)C)c1
InChIInChI=1S/C18H21NO2/c1-13(2)19-18(20)16-9-4-5-10-17(16)21-12-15-8-6-7-14(3)11-15/h4-11,13H,12H2,1-3H3,(H,19,20)
InChIKeyYPQSRLFKRBJLNZ-UHFFFAOYSA-N
MW283.37 g/mol
LogP3.71
Rot. Bonds5

About 2-[(3-methylphenyl)methoxy]-N-propan-2-ylbenzamide

2-[(3-methylphenyl)methoxy]-N-propan-2-ylbenzamide (PubChem CID 18160109) has the molecular formula C18H21NO2 and a molecular weight of 283.37 g/mol. Its IUPAC name is 2-[(3-methylphenyl)methoxy]-N-propan-2-ylbenzamide.

Molecular Properties

Compound Name2-[(3-methylphenyl)methoxy]-N-propan-2-ylbenzamide
PubChem CID18160109
Molecular FormulaC18H21NO2
Molecular Weight283.37 g/mol
Exact Mass283.16
IUPAC Name2-[(3-methylphenyl)methoxy]-N-propan-2-ylbenzamide
SMILESCc1cccc(COc2ccccc2C(=O)NC(C)C)c1
InChIInChI=1S/C18H21NO2/c1-13(2)19-18(20)16-9-4-5-10-17(16)21-12-15-8-6-7-14(3)11-15/h4-11,13H,12H2,1-3H3,(H,19,20)
InChIKeyYPQSRLFKRBJLNZ-UHFFFAOYSA-N
XLogP3.71
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-benzhydryl-2-[(3-methylphenyl)methoxy]benzamide
CID 7930966
2-[(3-methylphenyl)methoxy]-N-phenylbenzamide
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N-[(1R)-1-(2,4-dimethylphenyl)ethyl]-2-phenylmethoxybenzamide
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N-(4-hydroxycyclohexyl)-2-[(3-methylphenyl)methoxy]benzamide
CID 24982275
[2-oxo-2-(pentan-3-ylamino)ethyl] 2-[(3-methylphenyl)methoxy]benzoate
CID 2500439
2-[(3-methylphenyl)methoxy]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide
CID 34828421
3-[(3-methylphenyl)methoxy]phthalic acid
CID 66906397
(2S,3R)-3-hydroxy-2-[(2-phenylmethoxybenzoyl)amino]butanoic acid
CID 54368898
3-(naphthalen-1-yloxymethyl)-N-propan-2-ylbenzamide
CID 891835
5-fluoro-2-[(3-methylphenyl)methoxy]benzoic acid
CID 115298089
N-(2-methyl-1,3-benzothiazol-6-yl)-2-[(3-methylphenyl)methoxy]benzamide
CID 7915256

Frequently Asked Questions

What is the IUPAC name of 2-[(3-methylphenyl)methoxy]-N-propan-2-ylbenzamide?
The IUPAC name of 2-[(3-methylphenyl)methoxy]-N-propan-2-ylbenzamide (CID 18160109) is 2-[(3-methylphenyl)methoxy]-N-propan-2-ylbenzamide.
What is the SMILES notation for 2-[(3-methylphenyl)methoxy]-N-propan-2-ylbenzamide?
The canonical SMILES for 2-[(3-methylphenyl)methoxy]-N-propan-2-ylbenzamide is Cc1cccc(COc2ccccc2C(=O)NC(C)C)c1.
What is the InChIKey of 2-[(3-methylphenyl)methoxy]-N-propan-2-ylbenzamide?
The InChIKey is YPQSRLFKRBJLNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO2/c1-13(2)19-18(20)16-9-4-5-10-17(16)21-12-15-8-6-7-14(3)11-15/h4-11,13H,12H2,1-3H3,(H,19,20).
What are the key properties of 2-[(3-methylphenyl)methoxy]-N-propan-2-ylbenzamide?
2-[(3-methylphenyl)methoxy]-N-propan-2-ylbenzamide has a molecular weight of 283.37 g/mol, XLogP of 3.71, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-methylphenyl)methoxy]-N-propan-2-ylbenzamide is sourced from PubChem (CID 18160109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).