2-ethoxy-N-[4-(3-methylpyrazol-1-yl)phenyl]benzamide

C19H19N3O2 — CID 39855049

IUPAC2-ethoxy-N-[4-(3-methylpyrazol-1-yl)phenyl]benzamide
SMILESCCOc1ccccc1C(=O)Nc1ccc(-n2ccc(C)n2)cc1
InChIInChI=1S/C19H19N3O2/c1-3-24-18-7-5-4-6-17(18)19(23)20-15-8-10-16(11-9-15)22-13-12-14(2)21-22/h4-13H,3H2,1-2H3,(H,20,23)
InChIKeyJAEATQFYNCWGAA-UHFFFAOYSA-N
MW321.38 g/mol
LogP3.83
Rot. Bonds5

About 2-ethoxy-N-[4-(3-methylpyrazol-1-yl)phenyl]benzamide

2-ethoxy-N-[4-(3-methylpyrazol-1-yl)phenyl]benzamide (PubChem CID 39855049) has the molecular formula C19H19N3O2 and a molecular weight of 321.38 g/mol. Its IUPAC name is 2-ethoxy-N-[4-(3-methylpyrazol-1-yl)phenyl]benzamide.

Molecular Properties

Compound Name2-ethoxy-N-[4-(3-methylpyrazol-1-yl)phenyl]benzamide
PubChem CID39855049
Molecular FormulaC19H19N3O2
Molecular Weight321.38 g/mol
Exact Mass321.15
IUPAC Name2-ethoxy-N-[4-(3-methylpyrazol-1-yl)phenyl]benzamide
SMILESCCOc1ccccc1C(=O)Nc1ccc(-n2ccc(C)n2)cc1
InChIInChI=1S/C19H19N3O2/c1-3-24-18-7-5-4-6-17(18)19(23)20-15-8-10-16(11-9-15)22-13-12-14(2)21-22/h4-13H,3H2,1-2H3,(H,20,23)
InChIKeyJAEATQFYNCWGAA-UHFFFAOYSA-N
XLogP3.83
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-ethoxy-N-[4-[(2-ethoxybenzoyl)amino]phenyl]benzamide
CID 1011206
4-ethoxy-N-[4-(3-methylpyrazol-1-yl)phenyl]benzamide
CID 35590532
ethyl N-[4-[(2-ethoxybenzoyl)amino]phenyl]carbamate
CID 110178230
2-ethoxy-N-(4-hydroxyphenyl)benzamide
CID 836714
N-[4-(3-methylpyrazol-1-yl)phenyl]pyridine-2-carboxamide
CID 16764916
2-ethoxy-N-[4-(propanoylamino)phenyl]benzamide
CID 17204882
2-ethoxy-N-(4-methoxyphenyl)benzamide
CID 5019237
2-ethoxy-N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]benzamide
CID 35534339
N-(4-butan-2-ylphenyl)-2-ethoxybenzamide
CID 2852282
2-ethoxy-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]benzamide
CID 47045513
2-ethoxy-N-[4-(2-methylpropoxy)phenyl]benzamide
CID 4940660
2-ethoxy-N-[4-(2-ethoxyethoxy)phenyl]benzamide
CID 17130609

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[4-(3-methylpyrazol-1-yl)phenyl]benzamide?
The IUPAC name of 2-ethoxy-N-[4-(3-methylpyrazol-1-yl)phenyl]benzamide (CID 39855049) is 2-ethoxy-N-[4-(3-methylpyrazol-1-yl)phenyl]benzamide.
What is the SMILES notation for 2-ethoxy-N-[4-(3-methylpyrazol-1-yl)phenyl]benzamide?
The canonical SMILES for 2-ethoxy-N-[4-(3-methylpyrazol-1-yl)phenyl]benzamide is CCOc1ccccc1C(=O)Nc1ccc(-n2ccc(C)n2)cc1.
What is the InChIKey of 2-ethoxy-N-[4-(3-methylpyrazol-1-yl)phenyl]benzamide?
The InChIKey is JAEATQFYNCWGAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O2/c1-3-24-18-7-5-4-6-17(18)19(23)20-15-8-10-16(11-9-15)22-13-12-14(2)21-22/h4-13H,3H2,1-2H3,(H,20,23).
What are the key properties of 2-ethoxy-N-[4-(3-methylpyrazol-1-yl)phenyl]benzamide?
2-ethoxy-N-[4-(3-methylpyrazol-1-yl)phenyl]benzamide has a molecular weight of 321.38 g/mol, XLogP of 3.83, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[4-(3-methylpyrazol-1-yl)phenyl]benzamide is sourced from PubChem (CID 39855049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).