N-butan-2-yl-2-[(3-methoxybenzoyl)amino]benzamide

C19H22N2O3 — CID 17417921

IUPACN-butan-2-yl-2-[(3-methoxybenzoyl)amino]benzamide
SMILESCCC(C)NC(=O)c1ccccc1NC(=O)c1cccc(OC)c1
InChIInChI=1S/C19H22N2O3/c1-4-13(2)20-19(23)16-10-5-6-11-17(16)21-18(22)14-8-7-9-15(12-14)24-3/h5-13H,4H2,1-3H3,(H,20,23)(H,21,22)
InChIKeyVAPUFOZGSFIFDS-UHFFFAOYSA-N
MW326.40 g/mol
LogP3.48
Rot. Bonds6

About N-butan-2-yl-2-[(3-methoxybenzoyl)amino]benzamide

N-butan-2-yl-2-[(3-methoxybenzoyl)amino]benzamide (PubChem CID 17417921) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is N-butan-2-yl-2-[(3-methoxybenzoyl)amino]benzamide.

Molecular Properties

Compound NameN-butan-2-yl-2-[(3-methoxybenzoyl)amino]benzamide
PubChem CID17417921
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC NameN-butan-2-yl-2-[(3-methoxybenzoyl)amino]benzamide
SMILESCCC(C)NC(=O)c1ccccc1NC(=O)c1cccc(OC)c1
InChIInChI=1S/C19H22N2O3/c1-4-13(2)20-19(23)16-10-5-6-11-17(16)21-18(22)14-8-7-9-15(12-14)24-3/h5-13H,4H2,1-3H3,(H,20,23)(H,21,22)
InChIKeyVAPUFOZGSFIFDS-UHFFFAOYSA-N
XLogP3.48
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-butan-2-yl-2-[2-(3-methoxyphenoxy)propanoylamino]benzamide
CID 43877103
N-[(2R)-butan-2-yl]-2-[(3-fluorobenzoyl)amino]benzamide
CID 26706214
N-[(2R)-butan-2-yl]-2-[[2-(3-methoxyphenoxy)acetyl]amino]benzamide
CID 94592415
N-butan-2-yl-2-[(2-methoxybenzoyl)amino]benzamide
CID 3936748
2-[(3-methoxybenzoyl)amino]-N-(3-methoxyphenyl)benzamide
CID 51154923
N-[(2R)-butan-2-yl]-2-[[3-(methylsulfamoyl)benzoyl]amino]benzamide
CID 34735238
2-[(3-butan-2-yloxybenzoyl)amino]-N-(1-phenylethyl)benzamide
CID 17149781
N-butan-2-yl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide
CID 133231331
N-butan-2-yl-2-[(4-methylbenzoyl)amino]benzamide
CID 2942993
N-[(2R)-butan-2-yl]-2-[(4-methylbenzoyl)amino]benzamide
CID 893770
N-butan-2-yl-2-[(4-fluorobenzoyl)amino]benzamide
CID 2943228
N-[2-[[(2R)-butan-2-yl]carbamoyl]phenyl]-2,3-dimethoxybenzamide
CID 95903703

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-2-[(3-methoxybenzoyl)amino]benzamide?
The IUPAC name of N-butan-2-yl-2-[(3-methoxybenzoyl)amino]benzamide (CID 17417921) is N-butan-2-yl-2-[(3-methoxybenzoyl)amino]benzamide.
What is the SMILES notation for N-butan-2-yl-2-[(3-methoxybenzoyl)amino]benzamide?
The canonical SMILES for N-butan-2-yl-2-[(3-methoxybenzoyl)amino]benzamide is CCC(C)NC(=O)c1ccccc1NC(=O)c1cccc(OC)c1.
What is the InChIKey of N-butan-2-yl-2-[(3-methoxybenzoyl)amino]benzamide?
The InChIKey is VAPUFOZGSFIFDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-4-13(2)20-19(23)16-10-5-6-11-17(16)21-18(22)14-8-7-9-15(12-14)24-3/h5-13H,4H2,1-3H3,(H,20,23)(H,21,22).
What are the key properties of N-butan-2-yl-2-[(3-methoxybenzoyl)amino]benzamide?
N-butan-2-yl-2-[(3-methoxybenzoyl)amino]benzamide has a molecular weight of 326.40 g/mol, XLogP of 3.48, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-2-[(3-methoxybenzoyl)amino]benzamide is sourced from PubChem (CID 17417921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).