N-[4-(dimethylcarbamoyl)phenyl]-3-(2-ethoxyethoxy)benzamide

C20H24N2O4 — CID 17231253

IUPACN-[4-(dimethylcarbamoyl)phenyl]-3-(2-ethoxyethoxy)benzamide
SMILESCCOCCOc1cccc(C(=O)Nc2ccc(C(=O)N(C)C)cc2)c1
InChIInChI=1S/C20H24N2O4/c1-4-25-12-13-26-18-7-5-6-16(14-18)19(23)21-17-10-8-15(9-11-17)20(24)22(2)3/h5-11,14H,4,12-13H2,1-3H3,(H,21,23)
InChIKeyDTUYZRVRXVXXLD-UHFFFAOYSA-N
MW356.42 g/mol
LogP3.06
Rot. Bonds8

About N-[4-(dimethylcarbamoyl)phenyl]-3-(2-ethoxyethoxy)benzamide

N-[4-(dimethylcarbamoyl)phenyl]-3-(2-ethoxyethoxy)benzamide (PubChem CID 17231253) has the molecular formula C20H24N2O4 and a molecular weight of 356.42 g/mol. Its IUPAC name is N-[4-(dimethylcarbamoyl)phenyl]-3-(2-ethoxyethoxy)benzamide.

Molecular Properties

Compound NameN-[4-(dimethylcarbamoyl)phenyl]-3-(2-ethoxyethoxy)benzamide
PubChem CID17231253
Molecular FormulaC20H24N2O4
Molecular Weight356.42 g/mol
Exact Mass356.17
IUPAC NameN-[4-(dimethylcarbamoyl)phenyl]-3-(2-ethoxyethoxy)benzamide
SMILESCCOCCOc1cccc(C(=O)Nc2ccc(C(=O)N(C)C)cc2)c1
InChIInChI=1S/C20H24N2O4/c1-4-25-12-13-26-18-7-5-6-16(14-18)19(23)21-17-10-8-15(9-11-17)20(24)22(2)3/h5-11,14H,4,12-13H2,1-3H3,(H,21,23)
InChIKeyDTUYZRVRXVXXLD-UHFFFAOYSA-N
XLogP3.06
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-(2-ethoxyethoxy)-N-[4-(ethylcarbamoyl)phenyl]benzamide
CID 17234430
N-(4-acetylphenyl)-3-(2-ethoxyethoxy)benzamide
CID 17139535
N-(4-acetamidophenyl)-3-(2-ethoxyethoxy)benzamide
CID 17139517
N-(4-benzamidophenyl)-3-(2-ethoxyethoxy)benzamide
CID 17235482
N-(4-carbamoylphenyl)-3-(2-ethoxyethoxy)benzamide
CID 17139541
3-(2-ethoxyethoxy)-N-(4-phenoxyphenyl)benzamide
CID 17139540
propyl 4-[[3-(2-ethoxyethoxy)benzoyl]amino]benzoate
CID 17139559
N-(3-acetylphenyl)-3-(2-ethoxyethoxy)benzamide
CID 2238701
N-(3,4-dichlorophenyl)-3-(2-ethoxyethoxy)benzamide
CID 17139550
N-[4-[methyl(phenyl)carbamoyl]phenyl]-3-(2-phenoxyethoxy)benzamide
CID 17230251
3-(2-ethoxyethoxy)-N-[4-(furan-2-ylmethylcarbamoyl)phenyl]benzamide
CID 28638494
3-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-propan-2-ylbenzamide
CID 17197543

Frequently Asked Questions

What is the IUPAC name of N-[4-(dimethylcarbamoyl)phenyl]-3-(2-ethoxyethoxy)benzamide?
The IUPAC name of N-[4-(dimethylcarbamoyl)phenyl]-3-(2-ethoxyethoxy)benzamide (CID 17231253) is N-[4-(dimethylcarbamoyl)phenyl]-3-(2-ethoxyethoxy)benzamide.
What is the SMILES notation for N-[4-(dimethylcarbamoyl)phenyl]-3-(2-ethoxyethoxy)benzamide?
The canonical SMILES for N-[4-(dimethylcarbamoyl)phenyl]-3-(2-ethoxyethoxy)benzamide is CCOCCOc1cccc(C(=O)Nc2ccc(C(=O)N(C)C)cc2)c1.
What is the InChIKey of N-[4-(dimethylcarbamoyl)phenyl]-3-(2-ethoxyethoxy)benzamide?
The InChIKey is DTUYZRVRXVXXLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4/c1-4-25-12-13-26-18-7-5-6-16(14-18)19(23)21-17-10-8-15(9-11-17)20(24)22(2)3/h5-11,14H,4,12-13H2,1-3H3,(H,21,23).
What are the key properties of N-[4-(dimethylcarbamoyl)phenyl]-3-(2-ethoxyethoxy)benzamide?
N-[4-(dimethylcarbamoyl)phenyl]-3-(2-ethoxyethoxy)benzamide has a molecular weight of 356.42 g/mol, XLogP of 3.06, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(dimethylcarbamoyl)phenyl]-3-(2-ethoxyethoxy)benzamide is sourced from PubChem (CID 17231253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).