N-(3-acetamidophenyl)-2-butoxybenzamide

C19H22N2O3 — CID 17189815

IUPACN-(3-acetamidophenyl)-2-butoxybenzamide
SMILESCCCCOc1ccccc1C(=O)Nc1cccc(NC(C)=O)c1
InChIInChI=1S/C19H22N2O3/c1-3-4-12-24-18-11-6-5-10-17(18)19(23)21-16-9-7-8-15(13-16)20-14(2)22/h5-11,13H,3-4,12H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyLGYJYOSWKAOJEL-UHFFFAOYSA-N
MW326.40 g/mol
LogP4.08
Rot. Bonds7

About N-(3-acetamidophenyl)-2-butoxybenzamide

N-(3-acetamidophenyl)-2-butoxybenzamide (PubChem CID 17189815) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is N-(3-acetamidophenyl)-2-butoxybenzamide.

Molecular Properties

Compound NameN-(3-acetamidophenyl)-2-butoxybenzamide
PubChem CID17189815
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC NameN-(3-acetamidophenyl)-2-butoxybenzamide
SMILESCCCCOc1ccccc1C(=O)Nc1cccc(NC(C)=O)c1
InChIInChI=1S/C19H22N2O3/c1-3-4-12-24-18-11-6-5-10-17(18)19(23)21-16-9-7-8-15(13-16)20-14(2)22/h5-11,13H,3-4,12H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyLGYJYOSWKAOJEL-UHFFFAOYSA-N
XLogP4.08
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 54.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(3-acetamidophenyl)-5-bromo-2-butoxybenzamide
CID 17189847
N-(3-acetylphenyl)-2-propoxybenzamide
CID 4947871
2-pentoxy-N-[3-(phenylcarbamoyl)phenyl]benzamide
CID 54781200
N-(3-carbamoylphenyl)-2-pentoxybenzamide
CID 26160536
2-butoxy-N-(4-methylphenyl)benzamide
CID 4940933
N-(3-acetamidophenyl)-5-bromo-2-hexoxybenzamide
CID 17189846
2-hexoxy-N-[3-(methylcarbamoyl)phenyl]benzamide
CID 17233105
2-butoxy-N-[4-[[4-[(2-butoxybenzoyl)amino]phenyl]methyl]phenyl]benzamide
CID 4941899
2-butoxy-N-(4-propoxyphenyl)benzamide
CID 4943156
N-(3-acetamidophenyl)-2-phenoxybenzamide
CID 3402859
N-(3,4-dimethylphenyl)-2-pentoxybenzamide
CID 4946489
2-hexoxy-N-(3-phenylmethoxyphenyl)benzamide
CID 17086084

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamidophenyl)-2-butoxybenzamide?
The IUPAC name of N-(3-acetamidophenyl)-2-butoxybenzamide (CID 17189815) is N-(3-acetamidophenyl)-2-butoxybenzamide.
What is the SMILES notation for N-(3-acetamidophenyl)-2-butoxybenzamide?
The canonical SMILES for N-(3-acetamidophenyl)-2-butoxybenzamide is CCCCOc1ccccc1C(=O)Nc1cccc(NC(C)=O)c1.
What is the InChIKey of N-(3-acetamidophenyl)-2-butoxybenzamide?
The InChIKey is LGYJYOSWKAOJEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-3-4-12-24-18-11-6-5-10-17(18)19(23)21-16-9-7-8-15(13-16)20-14(2)22/h5-11,13H,3-4,12H2,1-2H3,(H,20,22)(H,21,23).
What are the key properties of N-(3-acetamidophenyl)-2-butoxybenzamide?
N-(3-acetamidophenyl)-2-butoxybenzamide has a molecular weight of 326.40 g/mol, XLogP of 4.08, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamidophenyl)-2-butoxybenzamide is sourced from PubChem (CID 17189815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).