4-butoxy-3-methoxy-N-(3-methoxyphenyl)benzamide

C19H23NO4 — CID 26914609

IUPAC4-butoxy-3-methoxy-N-(3-methoxyphenyl)benzamide
SMILESCCCCOc1ccc(C(=O)Nc2cccc(OC)c2)cc1OC
InChIInChI=1S/C19H23NO4/c1-4-5-11-24-17-10-9-14(12-18(17)23-3)19(21)20-15-7-6-8-16(13-15)22-2/h6-10,12-13H,4-5,11H2,1-3H3,(H,20,21)
InChIKeyDCRXFPLGKLLCOO-UHFFFAOYSA-N
MW329.40 g/mol
LogP4.14
Rot. Bonds8

About 4-butoxy-3-methoxy-N-(3-methoxyphenyl)benzamide

4-butoxy-3-methoxy-N-(3-methoxyphenyl)benzamide (PubChem CID 26914609) has the molecular formula C19H23NO4 and a molecular weight of 329.40 g/mol. Its IUPAC name is 4-butoxy-3-methoxy-N-(3-methoxyphenyl)benzamide.

Molecular Properties

Compound Name4-butoxy-3-methoxy-N-(3-methoxyphenyl)benzamide
PubChem CID26914609
Molecular FormulaC19H23NO4
Molecular Weight329.40 g/mol
Exact Mass329.16
IUPAC Name4-butoxy-3-methoxy-N-(3-methoxyphenyl)benzamide
SMILESCCCCOc1ccc(C(=O)Nc2cccc(OC)c2)cc1OC
InChIInChI=1S/C19H23NO4/c1-4-5-11-24-17-10-9-14(12-18(17)23-3)19(21)20-15-7-6-8-16(13-15)22-2/h6-10,12-13H,4-5,11H2,1-3H3,(H,20,21)
InChIKeyDCRXFPLGKLLCOO-UHFFFAOYSA-N
XLogP4.14
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.40
LogP ≤ 54.14
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

4-hexoxy-N-(3-methoxyphenyl)benzamide
CID 4933605
3-methoxy-N-(3-methoxyphenyl)-4-prop-2-enoxybenzamide
CID 27167629
4-butoxy-3-ethoxy-N-(4-methoxyphenyl)benzamide
CID 27228846
4-hexoxy-3-methoxy-N-(3-methylsulfonylphenyl)benzamide
CID 9071230
4-[(4-chlorophenyl)methoxy]-3-methoxy-N-(3-methoxyphenyl)benzamide
CID 4614010
4-butoxy-3-methoxy-N-(2-propoxyphenyl)benzamide
CID 26897955
4-butoxy-N-(3-chloro-4-methylphenyl)-3-methoxybenzamide
CID 2187837
N-(2-amino-5-methoxyphenyl)-4-butoxy-3-methoxybenzamide;hydrochloride
CID 119421240
4-butoxy-N-(3-fluoro-4-methylphenyl)-3-methoxybenzamide
CID 9216174
3-amino-4-methoxy-N-(3-methoxyphenyl)benzamide
CID 16785828
4-ethoxy-3-fluoro-N-(3-methoxyphenyl)benzamide
CID 110762258
butyl 3-[(3-methoxybenzoyl)amino]benzoate
CID 19166278

Frequently Asked Questions

What is the IUPAC name of 4-butoxy-3-methoxy-N-(3-methoxyphenyl)benzamide?
The IUPAC name of 4-butoxy-3-methoxy-N-(3-methoxyphenyl)benzamide (CID 26914609) is 4-butoxy-3-methoxy-N-(3-methoxyphenyl)benzamide.
What is the SMILES notation for 4-butoxy-3-methoxy-N-(3-methoxyphenyl)benzamide?
The canonical SMILES for 4-butoxy-3-methoxy-N-(3-methoxyphenyl)benzamide is CCCCOc1ccc(C(=O)Nc2cccc(OC)c2)cc1OC.
What is the InChIKey of 4-butoxy-3-methoxy-N-(3-methoxyphenyl)benzamide?
The InChIKey is DCRXFPLGKLLCOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO4/c1-4-5-11-24-17-10-9-14(12-18(17)23-3)19(21)20-15-7-6-8-16(13-15)22-2/h6-10,12-13H,4-5,11H2,1-3H3,(H,20,21).
What are the key properties of 4-butoxy-3-methoxy-N-(3-methoxyphenyl)benzamide?
4-butoxy-3-methoxy-N-(3-methoxyphenyl)benzamide has a molecular weight of 329.40 g/mol, XLogP of 4.14, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-butoxy-3-methoxy-N-(3-methoxyphenyl)benzamide is sourced from PubChem (CID 26914609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).