N-(2-methylpropyl)-2-[[4-(4-methylpyrazol-1-yl)benzoyl]amino]benzamide

C22H24N4O2 — CID 55772351

IUPACN-(2-methylpropyl)-2-[[4-(4-methylpyrazol-1-yl)benzoyl]amino]benzamide
SMILESCc1cnn(-c2ccc(C(=O)Nc3ccccc3C(=O)NCC(C)C)cc2)c1
InChIInChI=1S/C22H24N4O2/c1-15(2)12-23-22(28)19-6-4-5-7-20(19)25-21(27)17-8-10-18(11-9-17)26-14-16(3)13-24-26/h4-11,13-15H,12H2,1-3H3,(H,23,28)(H,25,27)
InChIKeyYRCNMWDCARYHKS-UHFFFAOYSA-N
MW376.46 g/mol
LogP3.82
Rot. Bonds6

About N-(2-methylpropyl)-2-[[4-(4-methylpyrazol-1-yl)benzoyl]amino]benzamide

N-(2-methylpropyl)-2-[[4-(4-methylpyrazol-1-yl)benzoyl]amino]benzamide (PubChem CID 55772351) has the molecular formula C22H24N4O2 and a molecular weight of 376.46 g/mol. Its IUPAC name is N-(2-methylpropyl)-2-[[4-(4-methylpyrazol-1-yl)benzoyl]amino]benzamide.

Molecular Properties

Compound NameN-(2-methylpropyl)-2-[[4-(4-methylpyrazol-1-yl)benzoyl]amino]benzamide
PubChem CID55772351
Molecular FormulaC22H24N4O2
Molecular Weight376.46 g/mol
Exact Mass376.19
IUPAC NameN-(2-methylpropyl)-2-[[4-(4-methylpyrazol-1-yl)benzoyl]amino]benzamide
SMILESCc1cnn(-c2ccc(C(=O)Nc3ccccc3C(=O)NCC(C)C)cc2)c1
InChIInChI=1S/C22H24N4O2/c1-15(2)12-23-22(28)19-6-4-5-7-20(19)25-21(27)17-8-10-18(11-9-17)26-14-16(3)13-24-26/h4-11,13-15H,12H2,1-3H3,(H,23,28)(H,25,27)
InChIKeyYRCNMWDCARYHKS-UHFFFAOYSA-N
XLogP3.82
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 53.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(4-tert-butylbenzoyl)amino]-N-(2-methylpropyl)benzamide
CID 1318988
N-(2-methylpropyl)-2-[3-(1-phenylpyrazol-4-yl)propanoylamino]benzamide
CID 34733192
3-fluoro-4-methyl-N-[2-(2-methylpropylcarbamoyl)phenyl]benzamide
CID 34732619
N-[2-(5-ethyl-1H-1,2,4-triazol-3-yl)phenyl]-4-(4-methylpyrazol-1-yl)benzamide
CID 138989490
[4-[[2-(2-methylpropylcarbamoyl)phenyl]carbamoyl]phenyl] acetate
CID 1369781
N-[2-methyl-3-(methylsulfanylmethyl)phenyl]-4-(4-methylpyrazol-1-yl)benzamide
CID 99405717
ethyl 2-[[4-(2-methylpropylcarbamoyl)benzoyl]amino]benzoate
CID 109044011
2-[[4-(ethylsulfonylamino)benzoyl]amino]-N-(2-methylpropyl)benzamide
CID 92643139
2-[[4-[dimethylsulfamoyl(methyl)amino]benzoyl]amino]-N-(2-methylpropyl)benzamide
CID 92664179
2-[[4-[methyl(methylsulfonyl)amino]benzoyl]amino]-N-(2-methylpropyl)benzamide
CID 4143005
N-(2-hydroxy-2,3-dimethylbutyl)-4-(4-methylpyrazol-1-yl)benzamide
CID 111484297
3,4-dimethoxy-N-[2-(2-methylpropylcarbamoyl)phenyl]benzamide
CID 18089928

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-2-[[4-(4-methylpyrazol-1-yl)benzoyl]amino]benzamide?
The IUPAC name of N-(2-methylpropyl)-2-[[4-(4-methylpyrazol-1-yl)benzoyl]amino]benzamide (CID 55772351) is N-(2-methylpropyl)-2-[[4-(4-methylpyrazol-1-yl)benzoyl]amino]benzamide.
What is the SMILES notation for N-(2-methylpropyl)-2-[[4-(4-methylpyrazol-1-yl)benzoyl]amino]benzamide?
The canonical SMILES for N-(2-methylpropyl)-2-[[4-(4-methylpyrazol-1-yl)benzoyl]amino]benzamide is Cc1cnn(-c2ccc(C(=O)Nc3ccccc3C(=O)NCC(C)C)cc2)c1.
What is the InChIKey of N-(2-methylpropyl)-2-[[4-(4-methylpyrazol-1-yl)benzoyl]amino]benzamide?
The InChIKey is YRCNMWDCARYHKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O2/c1-15(2)12-23-22(28)19-6-4-5-7-20(19)25-21(27)17-8-10-18(11-9-17)26-14-16(3)13-24-26/h4-11,13-15H,12H2,1-3H3,(H,23,28)(H,25,27).
What are the key properties of N-(2-methylpropyl)-2-[[4-(4-methylpyrazol-1-yl)benzoyl]amino]benzamide?
N-(2-methylpropyl)-2-[[4-(4-methylpyrazol-1-yl)benzoyl]amino]benzamide has a molecular weight of 376.46 g/mol, XLogP of 3.82, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-2-[[4-(4-methylpyrazol-1-yl)benzoyl]amino]benzamide is sourced from PubChem (CID 55772351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).