N-(2,6-dimethylphenyl)-2-(4-methylpyrazol-1-yl)propanamide

C15H19N3O — CID 19534343

IUPACN-(2,6-dimethylphenyl)-2-(4-methylpyrazol-1-yl)propanamide
SMILESCc1cnn(C(C)C(=O)Nc2c(C)cccc2C)c1
InChIInChI=1S/C15H19N3O/c1-10-8-16-18(9-10)13(4)15(19)17-14-11(2)6-5-7-12(14)3/h5-9,13H,1-4H3,(H,17,19)
InChIKeyCYBCYRZSMSBUGH-UHFFFAOYSA-N
MW257.34 g/mol
LogP3.01
Rot. Bonds3

About N-(2,6-dimethylphenyl)-2-(4-methylpyrazol-1-yl)propanamide

N-(2,6-dimethylphenyl)-2-(4-methylpyrazol-1-yl)propanamide (PubChem CID 19534343) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is N-(2,6-dimethylphenyl)-2-(4-methylpyrazol-1-yl)propanamide.

Molecular Properties

Compound NameN-(2,6-dimethylphenyl)-2-(4-methylpyrazol-1-yl)propanamide
PubChem CID19534343
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC NameN-(2,6-dimethylphenyl)-2-(4-methylpyrazol-1-yl)propanamide
SMILESCc1cnn(C(C)C(=O)Nc2c(C)cccc2C)c1
InChIInChI=1S/C15H19N3O/c1-10-8-16-18(9-10)13(4)15(19)17-14-11(2)6-5-7-12(14)3/h5-9,13H,1-4H3,(H,17,19)
InChIKeyCYBCYRZSMSBUGH-UHFFFAOYSA-N
XLogP3.01
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-methylpyrazol-1-yl)-N-(2,3,4,5,6-pentafluorophenyl)propanamide
CID 19534387
N-(2,6-dimethylphenyl)-2-pyrazol-1-ylpropanamide
CID 47156281
2-(4-methylpyrazol-1-yl)-N-[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]propanamide
CID 19534423
N-(2-cyanophenyl)-2-(4-methylpyrazol-1-yl)propanamide
CID 19534474
2-(4-methylpyrazol-1-yl)-N-(2-phenylsulfanylphenyl)propanamide
CID 19534326
N-(furan-2-ylmethyl)-2-(4-methylpyrazol-1-yl)propanamide
CID 19534412
N-[1-[(3-fluorophenyl)methyl]pyrazol-4-yl]-2-(4-methylpyrazol-1-yl)propanamide
CID 19534484
N-[1-[(3-chlorophenyl)methyl]pyrazol-4-yl]-2-(4-methylpyrazol-1-yl)propanamide
CID 19534489
N-[2-(4-chlorophenyl)sulfanylphenyl]-2-(4-methylpyrazol-1-yl)propanamide
CID 19584490
N-(2,6-dimethylphenyl)-2-methylpropanamide;yttrium
CID 158388394
2-(4-methylpyrazol-1-yl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]propanamide
CID 19534360
N-[1-[(4-chlorophenyl)methyl]pyrazol-4-yl]-2-(4-methylpyrazol-1-yl)propanamide
CID 19534314

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylphenyl)-2-(4-methylpyrazol-1-yl)propanamide?
The IUPAC name of N-(2,6-dimethylphenyl)-2-(4-methylpyrazol-1-yl)propanamide (CID 19534343) is N-(2,6-dimethylphenyl)-2-(4-methylpyrazol-1-yl)propanamide.
What is the SMILES notation for N-(2,6-dimethylphenyl)-2-(4-methylpyrazol-1-yl)propanamide?
The canonical SMILES for N-(2,6-dimethylphenyl)-2-(4-methylpyrazol-1-yl)propanamide is Cc1cnn(C(C)C(=O)Nc2c(C)cccc2C)c1.
What is the InChIKey of N-(2,6-dimethylphenyl)-2-(4-methylpyrazol-1-yl)propanamide?
The InChIKey is CYBCYRZSMSBUGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-10-8-16-18(9-10)13(4)15(19)17-14-11(2)6-5-7-12(14)3/h5-9,13H,1-4H3,(H,17,19).
What are the key properties of N-(2,6-dimethylphenyl)-2-(4-methylpyrazol-1-yl)propanamide?
N-(2,6-dimethylphenyl)-2-(4-methylpyrazol-1-yl)propanamide has a molecular weight of 257.34 g/mol, XLogP of 3.01, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylphenyl)-2-(4-methylpyrazol-1-yl)propanamide is sourced from PubChem (CID 19534343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).