N-methoxy-4-methyl-N-(4-methylbenzoyl)benzamide

C17H17NO3 — CID 134120196

IUPACN-methoxy-4-methyl-N-(4-methylbenzoyl)benzamide
SMILESCON(C(=O)c1ccc(C)cc1)C(=O)c1ccc(C)cc1
InChIInChI=1S/C17H17NO3/c1-12-4-8-14(9-5-12)16(19)18(21-3)17(20)15-10-6-13(2)7-11-15/h4-11H,1-3H3
InChIKeySCOVEMYTQHHYOT-UHFFFAOYSA-N
MW283.33 g/mol
LogP3.15
Rot. Bonds3

About N-methoxy-4-methyl-N-(4-methylbenzoyl)benzamide

N-methoxy-4-methyl-N-(4-methylbenzoyl)benzamide (PubChem CID 134120196) has the molecular formula C17H17NO3 and a molecular weight of 283.33 g/mol. Its IUPAC name is N-methoxy-4-methyl-N-(4-methylbenzoyl)benzamide.

Molecular Properties

Compound NameN-methoxy-4-methyl-N-(4-methylbenzoyl)benzamide
PubChem CID134120196
Molecular FormulaC17H17NO3
Molecular Weight283.33 g/mol
Exact Mass283.12
IUPAC NameN-methoxy-4-methyl-N-(4-methylbenzoyl)benzamide
SMILESCON(C(=O)c1ccc(C)cc1)C(=O)c1ccc(C)cc1
InChIInChI=1S/C17H17NO3/c1-12-4-8-14(9-5-12)16(19)18(21-3)17(20)15-10-6-13(2)7-11-15/h4-11H,1-3H3
InChIKeySCOVEMYTQHHYOT-UHFFFAOYSA-N
XLogP3.15
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Related Compounds

N-benzoyl-4-methylbenzohydrazide
CID 174274321
methyl 4-methylbenzoate
CID 7455
methyl 4-methylbenzoate
CID 91113291
N-carbamoyl-N,4-dimethylbenzamide
CID 69411182
N-acetyl-4-methyl-N-(4-methylphenyl)benzamide
CID 163721412
4-methyl-N-(2-methylpropyl)benzohydrazide
CID 71176452
methyl 4-[(4-methylbenzoyl)carbamoyl]benzoate
CID 175211628
N-(2-methoxyethyl)-N-(3-methoxypropyl)-4-methylbenzamide
CID 70804384
ethane;4-methyl-N,N-dipropylbenzamide
CID 143600655
methyl 4-(N-(4-methoxycarbonylphenyl)-4-methylanilino)benzoate
CID 102198007
2-[2-methoxyethyl-(4-methylbenzoyl)amino]acetic acid
CID 54969089
[4-[4-(4-methoxybenzoyl)benzoyl]phenyl]-(4-methylphenyl)methanone
CID 90306891

Frequently Asked Questions

What is the IUPAC name of N-methoxy-4-methyl-N-(4-methylbenzoyl)benzamide?
The IUPAC name of N-methoxy-4-methyl-N-(4-methylbenzoyl)benzamide (CID 134120196) is N-methoxy-4-methyl-N-(4-methylbenzoyl)benzamide.
What is the SMILES notation for N-methoxy-4-methyl-N-(4-methylbenzoyl)benzamide?
The canonical SMILES for N-methoxy-4-methyl-N-(4-methylbenzoyl)benzamide is CON(C(=O)c1ccc(C)cc1)C(=O)c1ccc(C)cc1.
What is the InChIKey of N-methoxy-4-methyl-N-(4-methylbenzoyl)benzamide?
The InChIKey is SCOVEMYTQHHYOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO3/c1-12-4-8-14(9-5-12)16(19)18(21-3)17(20)15-10-6-13(2)7-11-15/h4-11H,1-3H3.
What are the key properties of N-methoxy-4-methyl-N-(4-methylbenzoyl)benzamide?
N-methoxy-4-methyl-N-(4-methylbenzoyl)benzamide has a molecular weight of 283.33 g/mol, XLogP of 3.15, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-4-methyl-N-(4-methylbenzoyl)benzamide is sourced from PubChem (CID 134120196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).