N-(2,5-dimethylpyrazol-3-yl)-4-propan-2-yloxybenzamide

C15H19N3O2 — CID 45284563

IUPACN-(2,5-dimethylpyrazol-3-yl)-4-propan-2-yloxybenzamide
SMILESCc1cc(NC(=O)c2ccc(OC(C)C)cc2)n(C)n1
InChIInChI=1S/C15H19N3O2/c1-10(2)20-13-7-5-12(6-8-13)15(19)16-14-9-11(3)17-18(14)4/h5-10H,1-4H3,(H,16,19)
InChIKeyHQTWJMWLXFJCLX-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.77
Rot. Bonds4

About N-(2,5-dimethylpyrazol-3-yl)-4-propan-2-yloxybenzamide

N-(2,5-dimethylpyrazol-3-yl)-4-propan-2-yloxybenzamide (PubChem CID 45284563) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is N-(2,5-dimethylpyrazol-3-yl)-4-propan-2-yloxybenzamide.

Molecular Properties

Compound NameN-(2,5-dimethylpyrazol-3-yl)-4-propan-2-yloxybenzamide
PubChem CID45284563
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC NameN-(2,5-dimethylpyrazol-3-yl)-4-propan-2-yloxybenzamide
SMILESCc1cc(NC(=O)c2ccc(OC(C)C)cc2)n(C)n1
InChIInChI=1S/C15H19N3O2/c1-10(2)20-13-7-5-12(6-8-13)15(19)16-14-9-11(3)17-18(14)4/h5-10H,1-4H3,(H,16,19)
InChIKeyHQTWJMWLXFJCLX-UHFFFAOYSA-N
XLogP2.77
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-tert-butyl-N-(2,5-dimethylpyrazol-3-yl)benzamide
CID 10038843
N-[2-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-4-propan-2-yloxybenzamide
CID 135753066
4-amino-N-(2,5-dimethylpyrazol-3-yl)-3-methylbenzamide
CID 16784587
N-(2,5-dimethylpyrazol-3-yl)-3,4-diethoxybenzamide
CID 35291217
4-(difluoromethoxy)-N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]benzamide
CID 112805768
4-propan-2-yloxy-N-(3-propan-2-yloxyphenyl)benzamide
CID 17154760
N-(3,5-dibromo-4-hydroxyphenyl)-4-propan-2-yloxybenzamide
CID 5119029
N-(2,5-dimethylpyrazol-3-yl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
CID 104614459
N-(2,5-dimethylpyrazol-3-yl)-2,3-dihydro-1H-indole-5-carboxamide
CID 43325652
4-(methylamino)-N-(4-propan-2-yloxyphenyl)benzamide
CID 62166478
N-[2-[1-(2,4-dimethylphenyl)pyrazolo[5,4-d]pyrimidin-4-yl]-5-methylpyrazol-3-yl]-4-propan-2-yloxybenzamide
CID 27487047
N-(2-hydroxy-4-methylphenyl)-4-propan-2-yloxybenzamide
CID 27681755

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethylpyrazol-3-yl)-4-propan-2-yloxybenzamide?
The IUPAC name of N-(2,5-dimethylpyrazol-3-yl)-4-propan-2-yloxybenzamide (CID 45284563) is N-(2,5-dimethylpyrazol-3-yl)-4-propan-2-yloxybenzamide.
What is the SMILES notation for N-(2,5-dimethylpyrazol-3-yl)-4-propan-2-yloxybenzamide?
The canonical SMILES for N-(2,5-dimethylpyrazol-3-yl)-4-propan-2-yloxybenzamide is Cc1cc(NC(=O)c2ccc(OC(C)C)cc2)n(C)n1.
What is the InChIKey of N-(2,5-dimethylpyrazol-3-yl)-4-propan-2-yloxybenzamide?
The InChIKey is HQTWJMWLXFJCLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-10(2)20-13-7-5-12(6-8-13)15(19)16-14-9-11(3)17-18(14)4/h5-10H,1-4H3,(H,16,19).
What are the key properties of N-(2,5-dimethylpyrazol-3-yl)-4-propan-2-yloxybenzamide?
N-(2,5-dimethylpyrazol-3-yl)-4-propan-2-yloxybenzamide has a molecular weight of 273.34 g/mol, XLogP of 2.77, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethylpyrazol-3-yl)-4-propan-2-yloxybenzamide is sourced from PubChem (CID 45284563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).