4-methyl-N-(3-propan-2-yloxyphenyl)benzamide

C17H19NO2 — CID 2989293

IUPAC4-methyl-N-(3-propan-2-yloxyphenyl)benzamide
SMILESCc1ccc(C(=O)Nc2cccc(OC(C)C)c2)cc1
InChIInChI=1S/C17H19NO2/c1-12(2)20-16-6-4-5-15(11-16)18-17(19)14-9-7-13(3)8-10-14/h4-12H,1-3H3,(H,18,19)
InChIKeyDYQXLMRICWSDJU-UHFFFAOYSA-N
MW269.34 g/mol
LogP4.03
Rot. Bonds4

About 4-methyl-N-(3-propan-2-yloxyphenyl)benzamide

4-methyl-N-(3-propan-2-yloxyphenyl)benzamide (PubChem CID 2989293) has the molecular formula C17H19NO2 and a molecular weight of 269.34 g/mol. Its IUPAC name is 4-methyl-N-(3-propan-2-yloxyphenyl)benzamide.

Molecular Properties

Compound Name4-methyl-N-(3-propan-2-yloxyphenyl)benzamide
PubChem CID2989293
Molecular FormulaC17H19NO2
Molecular Weight269.34 g/mol
Exact Mass269.14
IUPAC Name4-methyl-N-(3-propan-2-yloxyphenyl)benzamide
SMILESCc1ccc(C(=O)Nc2cccc(OC(C)C)c2)cc1
InChIInChI=1S/C17H19NO2/c1-12(2)20-16-6-4-5-15(11-16)18-17(19)14-9-7-13(3)8-10-14/h4-12H,1-3H3,(H,18,19)
InChIKeyDYQXLMRICWSDJU-UHFFFAOYSA-N
XLogP4.03
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-propan-2-yloxy-N-(3-propan-2-yloxyphenyl)benzamide
CID 17154760
4-bromo-N-(3-propan-2-yloxyphenyl)benzamide
CID 54791087
4-methyl-N-(3-phenoxyphenyl)benzamide
CID 59304535
4-methyl-N-[3-(1-oxo-1-phenylbutan-2-yl)oxyphenyl]benzamide
CID 19645089
4-propan-2-yloxy-N-(3-propoxyphenyl)benzamide
CID 17096762
N-(3-chlorophenyl)-4-propan-2-yloxybenzamide
CID 823397
4-methyl-N-[5-[(3-propan-2-yloxyphenyl)sulfamoyl]-1,3,4-thiadiazol-2-yl]benzamide
CID 100711680
N-[3-[(1S)-1-hydroxyethyl]phenyl]-4-propan-2-yloxybenzamide
CID 100803572
1-N-(3-methylphenyl)-4-N-(2-propan-2-yloxyphenyl)benzene-1,4-dicarboxamide
CID 109049370
N-[3-[[(2S)-2-aminopropanoyl]amino]phenyl]-4-methylbenzamide
CID 46996402
N-[3-[(2R)-1-oxo-1-phenylpropan-2-yl]oxyphenyl]benzamide
CID 977194
3-N-(3-methylphenyl)-1-N-(4-propan-2-yloxyphenyl)benzene-1,3-dicarboxamide
CID 109056925

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(3-propan-2-yloxyphenyl)benzamide?
The IUPAC name of 4-methyl-N-(3-propan-2-yloxyphenyl)benzamide (CID 2989293) is 4-methyl-N-(3-propan-2-yloxyphenyl)benzamide.
What is the SMILES notation for 4-methyl-N-(3-propan-2-yloxyphenyl)benzamide?
The canonical SMILES for 4-methyl-N-(3-propan-2-yloxyphenyl)benzamide is Cc1ccc(C(=O)Nc2cccc(OC(C)C)c2)cc1.
What is the InChIKey of 4-methyl-N-(3-propan-2-yloxyphenyl)benzamide?
The InChIKey is DYQXLMRICWSDJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO2/c1-12(2)20-16-6-4-5-15(11-16)18-17(19)14-9-7-13(3)8-10-14/h4-12H,1-3H3,(H,18,19).
What are the key properties of 4-methyl-N-(3-propan-2-yloxyphenyl)benzamide?
4-methyl-N-(3-propan-2-yloxyphenyl)benzamide has a molecular weight of 269.34 g/mol, XLogP of 4.03, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(3-propan-2-yloxyphenyl)benzamide is sourced from PubChem (CID 2989293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).