2-ethoxy-N-(1,3,5-trimethylpyrazol-4-yl)benzamide

C15H19N3O2 — CID 19393618

IUPAC2-ethoxy-N-(1,3,5-trimethylpyrazol-4-yl)benzamide
SMILESCCOc1ccccc1C(=O)Nc1c(C)nn(C)c1C
InChIInChI=1S/C15H19N3O2/c1-5-20-13-9-7-6-8-12(13)15(19)16-14-10(2)17-18(4)11(14)3/h6-9H,5H2,1-4H3,(H,16,19)
InChIKeyCWUACCUZIVEZOB-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.69
Rot. Bonds4

About 2-ethoxy-N-(1,3,5-trimethylpyrazol-4-yl)benzamide

2-ethoxy-N-(1,3,5-trimethylpyrazol-4-yl)benzamide (PubChem CID 19393618) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 2-ethoxy-N-(1,3,5-trimethylpyrazol-4-yl)benzamide.

Molecular Properties

Compound Name2-ethoxy-N-(1,3,5-trimethylpyrazol-4-yl)benzamide
PubChem CID19393618
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name2-ethoxy-N-(1,3,5-trimethylpyrazol-4-yl)benzamide
SMILESCCOc1ccccc1C(=O)Nc1c(C)nn(C)c1C
InChIInChI=1S/C15H19N3O2/c1-5-20-13-9-7-6-8-12(13)15(19)16-14-10(2)17-18(4)11(14)3/h6-9H,5H2,1-4H3,(H,16,19)
InChIKeyCWUACCUZIVEZOB-UHFFFAOYSA-N
XLogP2.69
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 ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[2-(2-ethoxyphenoxy)acetyl]amino]-N-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 8810901
N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-ethoxybenzamide
CID 1043889
2-[(2-ethoxyphenyl)methyl-methylamino]-N-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 87014799
2-ethoxy-N-[4-[(2-ethoxybenzoyl)amino]phenyl]benzamide
CID 1011206
2-ethoxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide
CID 4106952
N-(2-ethoxyphenyl)-1,3-dimethylpyrazole-4-carboxamide
CID 42352848
N-[(1,3-dimethylpyrazol-4-yl)methyl]-2-ethoxybenzamide
CID 19288564
4-[(2-ethoxybenzoyl)amino]-1-methylpyrazole-5-carboxylic acid
CID 19406266
N-[(2,5-dimethylpyrazol-3-yl)methyl]-2-ethoxybenzamide
CID 19294449
N-[(1,5-dimethylpyrazol-4-yl)methyl]-2-ethoxybenzamide
CID 19282116
methyl 4-[(2-ethoxybenzoyl)amino]-1-methylpyrazole-5-carboxylate
CID 19342338
4-[(2-bromophenoxy)methyl]-N-(1,3,5-trimethylpyrazol-4-yl)benzamide
CID 19393367

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-(1,3,5-trimethylpyrazol-4-yl)benzamide?
The IUPAC name of 2-ethoxy-N-(1,3,5-trimethylpyrazol-4-yl)benzamide (CID 19393618) is 2-ethoxy-N-(1,3,5-trimethylpyrazol-4-yl)benzamide.
What is the SMILES notation for 2-ethoxy-N-(1,3,5-trimethylpyrazol-4-yl)benzamide?
The canonical SMILES for 2-ethoxy-N-(1,3,5-trimethylpyrazol-4-yl)benzamide is CCOc1ccccc1C(=O)Nc1c(C)nn(C)c1C.
What is the InChIKey of 2-ethoxy-N-(1,3,5-trimethylpyrazol-4-yl)benzamide?
The InChIKey is CWUACCUZIVEZOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-5-20-13-9-7-6-8-12(13)15(19)16-14-10(2)17-18(4)11(14)3/h6-9H,5H2,1-4H3,(H,16,19).
What are the key properties of 2-ethoxy-N-(1,3,5-trimethylpyrazol-4-yl)benzamide?
2-ethoxy-N-(1,3,5-trimethylpyrazol-4-yl)benzamide has a molecular weight of 273.34 g/mol, XLogP of 2.69, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-(1,3,5-trimethylpyrazol-4-yl)benzamide is sourced from PubChem (CID 19393618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).