2-benzoyl-N-(3-methoxypropyl)benzamide

C18H19NO3 — CID 11841231

IUPAC2-benzoyl-N-(3-methoxypropyl)benzamide
SMILESCOCCCNC(=O)c1ccccc1C(=O)c1ccccc1
InChIInChI=1S/C18H19NO3/c1-22-13-7-12-19-18(21)16-11-6-5-10-15(16)17(20)14-8-3-2-4-9-14/h2-6,8-11H,7,12-13H2,1H3,(H,19,21)
InChIKeyJANJVLJBIRNQSY-UHFFFAOYSA-N
MW297.35 g/mol
LogP2.68
Rot. Bonds7

About 2-benzoyl-N-(3-methoxypropyl)benzamide

2-benzoyl-N-(3-methoxypropyl)benzamide (PubChem CID 11841231) has the molecular formula C18H19NO3 and a molecular weight of 297.35 g/mol. Its IUPAC name is 2-benzoyl-N-(3-methoxypropyl)benzamide.

Molecular Properties

Compound Name2-benzoyl-N-(3-methoxypropyl)benzamide
PubChem CID11841231
Molecular FormulaC18H19NO3
Molecular Weight297.35 g/mol
Exact Mass297.14
IUPAC Name2-benzoyl-N-(3-methoxypropyl)benzamide
SMILESCOCCCNC(=O)c1ccccc1C(=O)c1ccccc1
InChIInChI=1S/C18H19NO3/c1-22-13-7-12-19-18(21)16-11-6-5-10-15(16)17(20)14-8-3-2-4-9-14/h2-6,8-11H,7,12-13H2,1H3,(H,19,21)
InChIKeyJANJVLJBIRNQSY-UHFFFAOYSA-N
XLogP2.68
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.35
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

methyl 4-[(2-benzoylbenzoyl)amino]butanoate
CID 33234645
2-benzoyl-N-[3-(dimethylamino)propyl]benzamide
CID 78793921
1-N,2-N-bis(2-methoxyethyl)benzene-1,2-dicarboxamide
CID 4574574
methyl 2-[(2-benzoylbenzoyl)amino]acetate
CID 26586239
2,3-difluoro-N-(3-methoxypropyl)benzamide
CID 62650844
(2R)-2-amino-6-[(2-benzoylbenzoyl)amino]hexanoic acid
CID 67015249
N-(3-methoxypropyl)-2-sulfamoylbenzamide
CID 43164716
3-N-(2-methoxyethyl)-1-N-(3-methoxypropyl)benzene-1,3-dicarboxamide
CID 109052487
N,N'-bis[2-(3-methoxypropylcarbamoyl)phenyl]hexanediamide
CID 17148582
2-(benzenesulfonamido)-N-(3-methoxypropyl)benzamide
CID 2967457
2-[(4-methoxy-4-oxobutyl)carbamoyl]benzoic acid
CID 60662850
2-(ethylamino)-N-(4-methoxybutyl)benzamide
CID 55047330

Frequently Asked Questions

What is the IUPAC name of 2-benzoyl-N-(3-methoxypropyl)benzamide?
The IUPAC name of 2-benzoyl-N-(3-methoxypropyl)benzamide (CID 11841231) is 2-benzoyl-N-(3-methoxypropyl)benzamide.
What is the SMILES notation for 2-benzoyl-N-(3-methoxypropyl)benzamide?
The canonical SMILES for 2-benzoyl-N-(3-methoxypropyl)benzamide is COCCCNC(=O)c1ccccc1C(=O)c1ccccc1.
What is the InChIKey of 2-benzoyl-N-(3-methoxypropyl)benzamide?
The InChIKey is JANJVLJBIRNQSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO3/c1-22-13-7-12-19-18(21)16-11-6-5-10-15(16)17(20)14-8-3-2-4-9-14/h2-6,8-11H,7,12-13H2,1H3,(H,19,21).
What are the key properties of 2-benzoyl-N-(3-methoxypropyl)benzamide?
2-benzoyl-N-(3-methoxypropyl)benzamide has a molecular weight of 297.35 g/mol, XLogP of 2.68, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzoyl-N-(3-methoxypropyl)benzamide is sourced from PubChem (CID 11841231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).