N-[4-(methylcarbamoyl)phenyl]-2-(2-methylpropoxy)benzamide

C19H22N2O3 — CID 28642656

IUPACN-[4-(methylcarbamoyl)phenyl]-2-(2-methylpropoxy)benzamide
SMILESCNC(=O)c1ccc(NC(=O)c2ccccc2OCC(C)C)cc1
InChIInChI=1S/C19H22N2O3/c1-13(2)12-24-17-7-5-4-6-16(17)19(23)21-15-10-8-14(9-11-15)18(22)20-3/h4-11,13H,12H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyNATUSYKXOLCHGX-UHFFFAOYSA-N
MW326.40 g/mol
LogP3.33
Rot. Bonds6

About N-[4-(methylcarbamoyl)phenyl]-2-(2-methylpropoxy)benzamide

N-[4-(methylcarbamoyl)phenyl]-2-(2-methylpropoxy)benzamide (PubChem CID 28642656) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is N-[4-(methylcarbamoyl)phenyl]-2-(2-methylpropoxy)benzamide.

Molecular Properties

Compound NameN-[4-(methylcarbamoyl)phenyl]-2-(2-methylpropoxy)benzamide
PubChem CID28642656
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC NameN-[4-(methylcarbamoyl)phenyl]-2-(2-methylpropoxy)benzamide
SMILESCNC(=O)c1ccc(NC(=O)c2ccccc2OCC(C)C)cc1
InChIInChI=1S/C19H22N2O3/c1-13(2)12-24-17-7-5-4-6-16(17)19(23)21-15-10-8-14(9-11-15)18(22)20-3/h4-11,13H,12H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyNATUSYKXOLCHGX-UHFFFAOYSA-N
XLogP3.33
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 ≤ 53.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(methylcarbamoyl)phenyl]-2-propan-2-yloxybenzamide
CID 28642699
N-methyl-4-[[2-[2-(2-methylpropoxy)anilino]acetyl]amino]benzamide
CID 54823920
2-hexoxy-N-[4-(methylcarbamoyl)phenyl]benzamide
CID 28642652
2-ethoxy-N-[4-(2-methylpropoxy)phenyl]benzamide
CID 4940660
N-(3,5-dimethylphenyl)-2-(2-methylpropoxy)benzamide
CID 4945346
N-(3-chloro-4-methoxyphenyl)-2-(2-methylpropoxy)benzamide
CID 4945530
2-(2-methylpropoxy)-N-[4-(3-phenylpropanoylamino)phenyl]benzamide
CID 17233576
2-(2-methylpropoxy)-N-[4-(phenylsulfamoyl)phenyl]benzamide
CID 4945295
N-(4-benzamidophenyl)-2-(3-methylbutoxy)benzamide
CID 17235412
N-[4-(diethylsulfamoyl)phenyl]-2-(2-methylpropoxy)benzamide
CID 4945399
N-(3-fluorophenyl)-2-(2-methylpropoxy)benzamide
CID 54788403
N-(3-acetamido-4-methylphenyl)-2-(2-methylpropoxy)benzamide
CID 54777043

Frequently Asked Questions

What is the IUPAC name of N-[4-(methylcarbamoyl)phenyl]-2-(2-methylpropoxy)benzamide?
The IUPAC name of N-[4-(methylcarbamoyl)phenyl]-2-(2-methylpropoxy)benzamide (CID 28642656) is N-[4-(methylcarbamoyl)phenyl]-2-(2-methylpropoxy)benzamide.
What is the SMILES notation for N-[4-(methylcarbamoyl)phenyl]-2-(2-methylpropoxy)benzamide?
The canonical SMILES for N-[4-(methylcarbamoyl)phenyl]-2-(2-methylpropoxy)benzamide is CNC(=O)c1ccc(NC(=O)c2ccccc2OCC(C)C)cc1.
What is the InChIKey of N-[4-(methylcarbamoyl)phenyl]-2-(2-methylpropoxy)benzamide?
The InChIKey is NATUSYKXOLCHGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-13(2)12-24-17-7-5-4-6-16(17)19(23)21-15-10-8-14(9-11-15)18(22)20-3/h4-11,13H,12H2,1-3H3,(H,20,22)(H,21,23).
What are the key properties of N-[4-(methylcarbamoyl)phenyl]-2-(2-methylpropoxy)benzamide?
N-[4-(methylcarbamoyl)phenyl]-2-(2-methylpropoxy)benzamide has a molecular weight of 326.40 g/mol, XLogP of 3.33, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(methylcarbamoyl)phenyl]-2-(2-methylpropoxy)benzamide is sourced from PubChem (CID 28642656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).