2-butoxy-N-(4-methylphenyl)benzamide

C18H21NO2 — CID 4940933

IUPAC2-butoxy-N-(4-methylphenyl)benzamide
SMILESCCCCOc1ccccc1C(=O)Nc1ccc(C)cc1
InChIInChI=1S/C18H21NO2/c1-3-4-13-21-17-8-6-5-7-16(17)18(20)19-15-11-9-14(2)10-12-15/h5-12H,3-4,13H2,1-2H3,(H,19,20)
InChIKeyDGEQGNLPFYFPBE-UHFFFAOYSA-N
MW283.37 g/mol
LogP4.43
Rot. Bonds6

About 2-butoxy-N-(4-methylphenyl)benzamide

2-butoxy-N-(4-methylphenyl)benzamide (PubChem CID 4940933) has the molecular formula C18H21NO2 and a molecular weight of 283.37 g/mol. Its IUPAC name is 2-butoxy-N-(4-methylphenyl)benzamide.

Molecular Properties

Compound Name2-butoxy-N-(4-methylphenyl)benzamide
PubChem CID4940933
Molecular FormulaC18H21NO2
Molecular Weight283.37 g/mol
Exact Mass283.16
IUPAC Name2-butoxy-N-(4-methylphenyl)benzamide
SMILESCCCCOc1ccccc1C(=O)Nc1ccc(C)cc1
InChIInChI=1S/C18H21NO2/c1-3-4-13-21-17-8-6-5-7-16(17)18(20)19-15-11-9-14(2)10-12-15/h5-12H,3-4,13H2,1-2H3,(H,19,20)
InChIKeyDGEQGNLPFYFPBE-UHFFFAOYSA-N
XLogP4.43
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-butoxy-N-[4-[[4-[(2-butoxybenzoyl)amino]phenyl]methyl]phenyl]benzamide
CID 4941899
2-butoxy-N-(4-propoxyphenyl)benzamide
CID 4943156
2-pentoxy-N-(4-propoxyphenyl)benzamide
CID 4946753
2-hexoxy-N-[4-(2-phenoxyethoxy)phenyl]benzamide
CID 4958241
N-(4-butoxyphenyl)-2-(2-phenylethoxy)benzamide
CID 19628186
N-(3,4-dimethylphenyl)-2-pentoxybenzamide
CID 4946489
methyl 4-[(2-pentoxybenzoyl)amino]benzoate
CID 4946584
2-(2-phenoxyethoxy)-N-(4-propoxyphenyl)benzamide
CID 4954419
N-(3-acetamidophenyl)-2-butoxybenzamide
CID 17189815
2-butoxy-N-[4-[(2,4-dimethylphenyl)sulfamoyl]phenyl]benzamide
CID 4940984
2-hexoxy-N-[4-(methylcarbamoyl)phenyl]benzamide
CID 28642652
N-[4-(diethylamino)phenyl]-2-hexoxybenzamide
CID 4941952

Frequently Asked Questions

What is the IUPAC name of 2-butoxy-N-(4-methylphenyl)benzamide?
The IUPAC name of 2-butoxy-N-(4-methylphenyl)benzamide (CID 4940933) is 2-butoxy-N-(4-methylphenyl)benzamide.
What is the SMILES notation for 2-butoxy-N-(4-methylphenyl)benzamide?
The canonical SMILES for 2-butoxy-N-(4-methylphenyl)benzamide is CCCCOc1ccccc1C(=O)Nc1ccc(C)cc1.
What is the InChIKey of 2-butoxy-N-(4-methylphenyl)benzamide?
The InChIKey is DGEQGNLPFYFPBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO2/c1-3-4-13-21-17-8-6-5-7-16(17)18(20)19-15-11-9-14(2)10-12-15/h5-12H,3-4,13H2,1-2H3,(H,19,20).
What are the key properties of 2-butoxy-N-(4-methylphenyl)benzamide?
2-butoxy-N-(4-methylphenyl)benzamide has a molecular weight of 283.37 g/mol, XLogP of 4.43, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butoxy-N-(4-methylphenyl)benzamide is sourced from PubChem (CID 4940933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).