N-[3-(benzylcarbamoyl)phenyl]-2-propoxybenzamide

C24H24N2O3 — CID 28638895

IUPACN-[3-(benzylcarbamoyl)phenyl]-2-propoxybenzamide
SMILESCCCOc1ccccc1C(=O)Nc1cccc(C(=O)NCc2ccccc2)c1
InChIInChI=1S/C24H24N2O3/c1-2-15-29-22-14-7-6-13-21(22)24(28)26-20-12-8-11-19(16-20)23(27)25-17-18-9-4-3-5-10-18/h3-14,16H,2,15,17H2,1H3,(H,25,27)(H,26,28)
InChIKeyYYAQPXRRDMOIKL-UHFFFAOYSA-N
MW388.47 g/mol
LogP4.66
Rot. Bonds8

About N-[3-(benzylcarbamoyl)phenyl]-2-propoxybenzamide

N-[3-(benzylcarbamoyl)phenyl]-2-propoxybenzamide (PubChem CID 28638895) has the molecular formula C24H24N2O3 and a molecular weight of 388.47 g/mol. Its IUPAC name is N-[3-(benzylcarbamoyl)phenyl]-2-propoxybenzamide.

Molecular Properties

Compound NameN-[3-(benzylcarbamoyl)phenyl]-2-propoxybenzamide
PubChem CID28638895
Molecular FormulaC24H24N2O3
Molecular Weight388.47 g/mol
Exact Mass388.18
IUPAC NameN-[3-(benzylcarbamoyl)phenyl]-2-propoxybenzamide
SMILESCCCOc1ccccc1C(=O)Nc1cccc(C(=O)NCc2ccccc2)c1
InChIInChI=1S/C24H24N2O3/c1-2-15-29-22-14-7-6-13-21(22)24(28)26-20-12-8-11-19(16-20)23(27)25-17-18-9-4-3-5-10-18/h3-14,16H,2,15,17H2,1H3,(H,25,27)(H,26,28)
InChIKeyYYAQPXRRDMOIKL-UHFFFAOYSA-N
XLogP4.66
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 54.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(benzylcarbamoyl)phenyl]-2-ethoxybenzamide
CID 28638874
N-[3-(benzylcarbamoyl)phenyl]-2-(2-phenylethoxy)benzamide
CID 28638963
N-[3-(benzylcarbamoyl)phenyl]-2-(2-phenoxyethoxy)benzamide
CID 28638908
N-(3-acetylphenyl)-2-propoxybenzamide
CID 4947871
N-[[3-(benzylcarbamoyl)phenyl]carbamothioyl]-2-(2-methoxyethoxy)benzamide
CID 28639081
2-pentoxy-N-[3-(phenylcarbamoyl)phenyl]benzamide
CID 54781200
N-[[3-(benzylcarbamoyl)phenyl]carbamothioyl]-5-bromo-2-propoxybenzamide
CID 43887166
N-[3-(oxolan-2-ylmethylcarbamoyl)phenyl]-2-propoxybenzamide
CID 17202343
N-[3-(benzylcarbamoyl)phenyl]-2-iodobenzamide
CID 28638781
N-[[4-(benzylcarbamoyl)phenyl]carbamothioyl]-2-propoxybenzamide
CID 28640124
N-[3-(butylcarbamoyl)phenyl]-2-(2-ethoxyethoxy)benzamide
CID 17197044
2-ethoxy-N-[3-(2-methoxyethylcarbamoyl)phenyl]benzamide
CID 17219003

Frequently Asked Questions

What is the IUPAC name of N-[3-(benzylcarbamoyl)phenyl]-2-propoxybenzamide?
The IUPAC name of N-[3-(benzylcarbamoyl)phenyl]-2-propoxybenzamide (CID 28638895) is N-[3-(benzylcarbamoyl)phenyl]-2-propoxybenzamide.
What is the SMILES notation for N-[3-(benzylcarbamoyl)phenyl]-2-propoxybenzamide?
The canonical SMILES for N-[3-(benzylcarbamoyl)phenyl]-2-propoxybenzamide is CCCOc1ccccc1C(=O)Nc1cccc(C(=O)NCc2ccccc2)c1.
What is the InChIKey of N-[3-(benzylcarbamoyl)phenyl]-2-propoxybenzamide?
The InChIKey is YYAQPXRRDMOIKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O3/c1-2-15-29-22-14-7-6-13-21(22)24(28)26-20-12-8-11-19(16-20)23(27)25-17-18-9-4-3-5-10-18/h3-14,16H,2,15,17H2,1H3,(H,25,27)(H,26,28).
What are the key properties of N-[3-(benzylcarbamoyl)phenyl]-2-propoxybenzamide?
N-[3-(benzylcarbamoyl)phenyl]-2-propoxybenzamide has a molecular weight of 388.47 g/mol, XLogP of 4.66, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(benzylcarbamoyl)phenyl]-2-propoxybenzamide is sourced from PubChem (CID 28638895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).