N-(3,4-diethoxyphenyl)-2-methylbenzamide

C18H21NO3 — CID 26212680

IUPACN-(3,4-diethoxyphenyl)-2-methylbenzamide
SMILESCCOc1ccc(NC(=O)c2ccccc2C)cc1OCC
InChIInChI=1S/C18H21NO3/c1-4-21-16-11-10-14(12-17(16)22-5-2)19-18(20)15-9-7-6-8-13(15)3/h6-12H,4-5H2,1-3H3,(H,19,20)
InChIKeySVIUIDOZEYPDLY-UHFFFAOYSA-N
MW299.37 g/mol
LogP4.04
Rot. Bonds6

About N-(3,4-diethoxyphenyl)-2-methylbenzamide

N-(3,4-diethoxyphenyl)-2-methylbenzamide (PubChem CID 26212680) has the molecular formula C18H21NO3 and a molecular weight of 299.37 g/mol. Its IUPAC name is N-(3,4-diethoxyphenyl)-2-methylbenzamide.

Molecular Properties

Compound NameN-(3,4-diethoxyphenyl)-2-methylbenzamide
PubChem CID26212680
Molecular FormulaC18H21NO3
Molecular Weight299.37 g/mol
Exact Mass299.15
IUPAC NameN-(3,4-diethoxyphenyl)-2-methylbenzamide
SMILESCCOc1ccc(NC(=O)c2ccccc2C)cc1OCC
InChIInChI=1S/C18H21NO3/c1-4-21-16-11-10-14(12-17(16)22-5-2)19-18(20)15-9-7-6-8-13(15)3/h6-12H,4-5H2,1-3H3,(H,19,20)
InChIKeySVIUIDOZEYPDLY-UHFFFAOYSA-N
XLogP4.04
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-ethoxyphenyl)-2-methylbenzamide
CID 710558
N-(4-ethoxy-3-methoxyphenyl)-2,5-dimethylbenzamide
CID 9100356
N-(5-acetyl-2-ethoxyphenyl)-2-methylbenzamide
CID 82156333
N-(3,4-diethoxyphenyl)pyridine-2-carboxamide
CID 17411866
2-ethoxy-N-[4-[(2-ethoxybenzoyl)amino]phenyl]benzamide
CID 1011206
N-[4-[(2-ethoxybenzoyl)carbamothioylamino]phenyl]-2-methylbenzamide
CID 17251773
N-(3,4-diethoxyphenyl)acetamide
CID 13120229
ethyl 3-[4-[(2-methylbenzoyl)amino]anilino]-3-oxopropanoate
CID 17251680
N-(4-ethoxy-3-methoxyphenyl)-2,4,5-trimethoxybenzamide
CID 9103295
N-(4-benzamido-2,5-diethoxyphenyl)-2-methylbenzamide
CID 1051986
N-(4-ethoxy-3-fluorophenyl)-2-hydroxybenzamide
CID 47314298
N-[2-[(4-ethoxyphenyl)carbamoyl]phenyl]-2-methylbenzamide
CID 4941456

Frequently Asked Questions

What is the IUPAC name of N-(3,4-diethoxyphenyl)-2-methylbenzamide?
The IUPAC name of N-(3,4-diethoxyphenyl)-2-methylbenzamide (CID 26212680) is N-(3,4-diethoxyphenyl)-2-methylbenzamide.
What is the SMILES notation for N-(3,4-diethoxyphenyl)-2-methylbenzamide?
The canonical SMILES for N-(3,4-diethoxyphenyl)-2-methylbenzamide is CCOc1ccc(NC(=O)c2ccccc2C)cc1OCC.
What is the InChIKey of N-(3,4-diethoxyphenyl)-2-methylbenzamide?
The InChIKey is SVIUIDOZEYPDLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO3/c1-4-21-16-11-10-14(12-17(16)22-5-2)19-18(20)15-9-7-6-8-13(15)3/h6-12H,4-5H2,1-3H3,(H,19,20).
What are the key properties of N-(3,4-diethoxyphenyl)-2-methylbenzamide?
N-(3,4-diethoxyphenyl)-2-methylbenzamide has a molecular weight of 299.37 g/mol, XLogP of 4.04, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-diethoxyphenyl)-2-methylbenzamide is sourced from PubChem (CID 26212680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).