4-methoxy-2-methyl-N-phenyl-5-propan-2-ylbenzamide

C18H21NO2 — CID 83407606

IUPAC4-methoxy-2-methyl-N-phenyl-5-propan-2-ylbenzamide
SMILESCOc1cc(C)c(C(=O)Nc2ccccc2)cc1C(C)C
InChIInChI=1S/C18H21NO2/c1-12(2)15-11-16(13(3)10-17(15)21-4)18(20)19-14-8-6-5-7-9-14/h5-12H,1-4H3,(H,19,20)
InChIKeyWODCJQNHHLZAHJ-UHFFFAOYSA-N
MW283.37 g/mol
LogP4.38
Rot. Bonds4

About 4-methoxy-2-methyl-N-phenyl-5-propan-2-ylbenzamide

4-methoxy-2-methyl-N-phenyl-5-propan-2-ylbenzamide (PubChem CID 83407606) has the molecular formula C18H21NO2 and a molecular weight of 283.37 g/mol. Its IUPAC name is 4-methoxy-2-methyl-N-phenyl-5-propan-2-ylbenzamide.

Molecular Properties

Compound Name4-methoxy-2-methyl-N-phenyl-5-propan-2-ylbenzamide
PubChem CID83407606
Molecular FormulaC18H21NO2
Molecular Weight283.37 g/mol
Exact Mass283.16
IUPAC Name4-methoxy-2-methyl-N-phenyl-5-propan-2-ylbenzamide
SMILESCOc1cc(C)c(C(=O)Nc2ccccc2)cc1C(C)C
InChIInChI=1S/C18H21NO2/c1-12(2)15-11-16(13(3)10-17(15)21-4)18(20)19-14-8-6-5-7-9-14/h5-12H,1-4H3,(H,19,20)
InChIKeyWODCJQNHHLZAHJ-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

N-(3,5-dichlorophenyl)-4-methoxy-2-methyl-5-propan-2-ylbenzamide
CID 100712843
N-(3,4-dichlorophenyl)-4-methoxy-2-methyl-5-propan-2-ylbenzamide
CID 100714297
N-(3-chloro-4-fluorophenyl)-4-methoxy-2-methyl-5-propan-2-ylbenzamide
CID 100713672
4-methoxy-2-methyl-N-[4-(4-methylpiperazin-1-yl)phenyl]-5-propan-2-ylbenzamide
CID 100716626
N-[2-(tert-butylcarbamoyl)phenyl]-4-methoxy-2-methyl-5-propan-2-ylbenzamide
CID 100715391
4-methoxy-N',2-dimethyl-5-propan-2-ylbenzohydrazide
CID 116846868
4-methoxy-2-methyl-N-[(1S)-3-methyl-1-phenylbutyl]-5-propan-2-ylbenzamide
CID 100715050
N-(4-chloro-2,5-dimethoxyphenyl)-4-methoxy-2-methyl-5-propan-2-ylbenzamide
CID 100715402
4-methoxy-2-methyl-N-[(2R)-3-methylbutan-2-yl]-5-propan-2-ylbenzamide
CID 100573271
4-methoxy-2-methyl-N-(2-methylpropyl)-5-propan-2-ylbenzamide
CID 83405819
N-(2-acetamidoethyl)-4-methoxy-2-methyl-5-propan-2-ylbenzamide
CID 110761820
N-[1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethyl]benzamide
CID 133186104

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-methyl-N-phenyl-5-propan-2-ylbenzamide?
The IUPAC name of 4-methoxy-2-methyl-N-phenyl-5-propan-2-ylbenzamide (CID 83407606) is 4-methoxy-2-methyl-N-phenyl-5-propan-2-ylbenzamide.
What is the SMILES notation for 4-methoxy-2-methyl-N-phenyl-5-propan-2-ylbenzamide?
The canonical SMILES for 4-methoxy-2-methyl-N-phenyl-5-propan-2-ylbenzamide is COc1cc(C)c(C(=O)Nc2ccccc2)cc1C(C)C.
What is the InChIKey of 4-methoxy-2-methyl-N-phenyl-5-propan-2-ylbenzamide?
The InChIKey is WODCJQNHHLZAHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO2/c1-12(2)15-11-16(13(3)10-17(15)21-4)18(20)19-14-8-6-5-7-9-14/h5-12H,1-4H3,(H,19,20).
What are the key properties of 4-methoxy-2-methyl-N-phenyl-5-propan-2-ylbenzamide?
4-methoxy-2-methyl-N-phenyl-5-propan-2-ylbenzamide 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 4-methoxy-2-methyl-N-phenyl-5-propan-2-ylbenzamide is sourced from PubChem (CID 83407606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).