3-methoxy-4-methyl-N-(4-propan-2-ylphenyl)benzamide

C18H21NO2 — CID 26585658

IUPAC3-methoxy-4-methyl-N-(4-propan-2-ylphenyl)benzamide
SMILESCOc1cc(C(=O)Nc2ccc(C(C)C)cc2)ccc1C
InChIInChI=1S/C18H21NO2/c1-12(2)14-7-9-16(10-8-14)19-18(20)15-6-5-13(3)17(11-15)21-4/h5-12H,1-4H3,(H,19,20)
InChIKeySCZAXFCSPGBUMO-UHFFFAOYSA-N
MW283.37 g/mol
LogP4.38
Rot. Bonds4

About 3-methoxy-4-methyl-N-(4-propan-2-ylphenyl)benzamide

3-methoxy-4-methyl-N-(4-propan-2-ylphenyl)benzamide (PubChem CID 26585658) has the molecular formula C18H21NO2 and a molecular weight of 283.37 g/mol. Its IUPAC name is 3-methoxy-4-methyl-N-(4-propan-2-ylphenyl)benzamide.

Molecular Properties

Compound Name3-methoxy-4-methyl-N-(4-propan-2-ylphenyl)benzamide
PubChem CID26585658
Molecular FormulaC18H21NO2
Molecular Weight283.37 g/mol
Exact Mass283.16
IUPAC Name3-methoxy-4-methyl-N-(4-propan-2-ylphenyl)benzamide
SMILESCOc1cc(C(=O)Nc2ccc(C(C)C)cc2)ccc1C
InChIInChI=1S/C18H21NO2/c1-12(2)14-7-9-16(10-8-14)19-18(20)15-6-5-13(3)17(11-15)21-4/h5-12H,1-4H3,(H,19,20)
InChIKeySCZAXFCSPGBUMO-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

3-methoxy-4-methyl-N-(4-methylphenyl)benzamide
CID 9071746
N-[4-(hydroxymethyl)phenyl]-3-methoxy-4-methylbenzamide
CID 64793166
N-(3,5-dimethoxyphenyl)-3-methoxy-4-methylbenzamide
CID 16619720
4-propan-2-yl-N-(4-propan-2-ylphenyl)benzamide
CID 1406437
N-(3-chloro-4-methoxyphenyl)-4-propan-2-ylbenzamide
CID 1406499
2-[4-[(3-methoxy-4-methylbenzoyl)amino]phenyl]-2-methylpropanoic acid
CID 119253822
1-N,3-N,5-N-tris(4-propan-2-ylphenyl)benzene-1,3,5-tricarboxamide
CID 67992142
3-(dimethylsulfamoyl)-4-methoxy-N-(4-propan-2-ylphenyl)benzamide
CID 45374027
N-(3,4-dimethylphenyl)-6-(2-methoxy-5-propan-2-ylphenyl)pyridine-3-carboxamide
CID 58639352
N-[1-(4-chlorophenyl)ethyl]-3-methoxy-4-methylbenzamide
CID 134013068
2-N-(3,4-dimethylphenyl)-4-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide
CID 109091918
2-[4-(3-methoxy-4-methylbenzoyl)piperazin-1-yl]-N-(4-propan-2-ylphenyl)acetamide
CID 60512130

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-4-methyl-N-(4-propan-2-ylphenyl)benzamide?
The IUPAC name of 3-methoxy-4-methyl-N-(4-propan-2-ylphenyl)benzamide (CID 26585658) is 3-methoxy-4-methyl-N-(4-propan-2-ylphenyl)benzamide.
What is the SMILES notation for 3-methoxy-4-methyl-N-(4-propan-2-ylphenyl)benzamide?
The canonical SMILES for 3-methoxy-4-methyl-N-(4-propan-2-ylphenyl)benzamide is COc1cc(C(=O)Nc2ccc(C(C)C)cc2)ccc1C.
What is the InChIKey of 3-methoxy-4-methyl-N-(4-propan-2-ylphenyl)benzamide?
The InChIKey is SCZAXFCSPGBUMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO2/c1-12(2)14-7-9-16(10-8-14)19-18(20)15-6-5-13(3)17(11-15)21-4/h5-12H,1-4H3,(H,19,20).
What are the key properties of 3-methoxy-4-methyl-N-(4-propan-2-ylphenyl)benzamide?
3-methoxy-4-methyl-N-(4-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 3-methoxy-4-methyl-N-(4-propan-2-ylphenyl)benzamide is sourced from PubChem (CID 26585658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).