N-(1,5-dimethylpyrazol-4-yl)-2,4,5-trimethylbenzamide

C15H19N3O — CID 134707317

IUPACN-(1,5-dimethylpyrazol-4-yl)-2,4,5-trimethylbenzamide
SMILESCc1cc(C)c(C(=O)Nc2cnn(C)c2C)cc1C
InChIInChI=1S/C15H19N3O/c1-9-6-11(3)13(7-10(9)2)15(19)17-14-8-16-18(5)12(14)4/h6-8H,1-5H3,(H,17,19)
InChIKeyXYEOSNDEAQVNCY-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.91
Rot. Bonds2

About N-(1,5-dimethylpyrazol-4-yl)-2,4,5-trimethylbenzamide

N-(1,5-dimethylpyrazol-4-yl)-2,4,5-trimethylbenzamide (PubChem CID 134707317) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is N-(1,5-dimethylpyrazol-4-yl)-2,4,5-trimethylbenzamide.

Molecular Properties

Compound NameN-(1,5-dimethylpyrazol-4-yl)-2,4,5-trimethylbenzamide
PubChem CID134707317
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC NameN-(1,5-dimethylpyrazol-4-yl)-2,4,5-trimethylbenzamide
SMILESCc1cc(C)c(C(=O)Nc2cnn(C)c2C)cc1C
InChIInChI=1S/C15H19N3O/c1-9-6-11(3)13(7-10(9)2)15(19)17-14-8-16-18(5)12(14)4/h6-8H,1-5H3,(H,17,19)
InChIKeyXYEOSNDEAQVNCY-UHFFFAOYSA-N
XLogP2.91
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1,5-dimethylpyrazol-4-yl)acetamide
CID 19399796
5-[(1,5-dimethylpyrazol-4-yl)carbamoyl]-1-methylpyrazole-4-carboxylic acid
CID 19494189
4-amino-N-(1,5-dimethylpyrazol-4-yl)-1-methylpyrazole-5-carboxamide
CID 7017546
4,5-dibromo-N-(1,5-dimethylpyrazol-4-yl)thiophene-2-carboxamide
CID 4773000
N-(2,5-dichlorophenyl)-1,5-dimethylpyrazole-4-carboxamide
CID 110864104
N-(4-bromo-2-methylphenyl)-1,5-dimethylpyrazole-4-carboxamide
CID 28780531
N-(1,5-dimethylpyrazol-4-yl)-4-methylquinoline-2-carboxamide
CID 139005259
N-(2-amino-4-chlorophenyl)-1,5-dimethylpyrazole-4-carboxamide
CID 28776782
methyl 4-[(1,5-dimethylpyrazole-4-carbonyl)amino]-1-methylpyrazole-5-carboxylate
CID 19342092
5-bromo-2-(difluoromethoxy)-N-(1,5-dimethylpyrazol-4-yl)benzamide
CID 19399689
2-cyclopropyl-N-(1,5-dimethylpyrazol-4-yl)pyridine-3-carboxamide
CID 127824011
N-(1,5-dimethylpyrazol-4-yl)-1-methyl-4-[(3-methylbenzoyl)amino]pyrazole-5-carboxamide
CID 19411137

Frequently Asked Questions

What is the IUPAC name of N-(1,5-dimethylpyrazol-4-yl)-2,4,5-trimethylbenzamide?
The IUPAC name of N-(1,5-dimethylpyrazol-4-yl)-2,4,5-trimethylbenzamide (CID 134707317) is N-(1,5-dimethylpyrazol-4-yl)-2,4,5-trimethylbenzamide.
What is the SMILES notation for N-(1,5-dimethylpyrazol-4-yl)-2,4,5-trimethylbenzamide?
The canonical SMILES for N-(1,5-dimethylpyrazol-4-yl)-2,4,5-trimethylbenzamide is Cc1cc(C)c(C(=O)Nc2cnn(C)c2C)cc1C.
What is the InChIKey of N-(1,5-dimethylpyrazol-4-yl)-2,4,5-trimethylbenzamide?
The InChIKey is XYEOSNDEAQVNCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-9-6-11(3)13(7-10(9)2)15(19)17-14-8-16-18(5)12(14)4/h6-8H,1-5H3,(H,17,19).
What are the key properties of N-(1,5-dimethylpyrazol-4-yl)-2,4,5-trimethylbenzamide?
N-(1,5-dimethylpyrazol-4-yl)-2,4,5-trimethylbenzamide has a molecular weight of 257.34 g/mol, XLogP of 2.91, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,5-dimethylpyrazol-4-yl)-2,4,5-trimethylbenzamide is sourced from PubChem (CID 134707317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).