4-ethoxy-N-(1-ethylpyrazol-3-yl)benzamide

C14H17N3O2 — CID 35286442

IUPAC4-ethoxy-N-(1-ethylpyrazol-3-yl)benzamide
SMILESCCOc1ccc(C(=O)Nc2ccn(CC)n2)cc1
InChIInChI=1S/C14H17N3O2/c1-3-17-10-9-13(16-17)15-14(18)11-5-7-12(8-6-11)19-4-2/h5-10H,3-4H2,1-2H3,(H,15,16,18)
InChIKeyPEVCYGJBNKKCEU-UHFFFAOYSA-N
MW259.31 g/mol
LogP2.55
Rot. Bonds5

About 4-ethoxy-N-(1-ethylpyrazol-3-yl)benzamide

4-ethoxy-N-(1-ethylpyrazol-3-yl)benzamide (PubChem CID 35286442) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is 4-ethoxy-N-(1-ethylpyrazol-3-yl)benzamide.

Molecular Properties

Compound Name4-ethoxy-N-(1-ethylpyrazol-3-yl)benzamide
PubChem CID35286442
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC Name4-ethoxy-N-(1-ethylpyrazol-3-yl)benzamide
SMILESCCOc1ccc(C(=O)Nc2ccn(CC)n2)cc1
InChIInChI=1S/C14H17N3O2/c1-3-17-10-9-13(16-17)15-14(18)11-5-7-12(8-6-11)19-4-2/h5-10H,3-4H2,1-2H3,(H,15,16,18)
InChIKeyPEVCYGJBNKKCEU-UHFFFAOYSA-N
XLogP2.55
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-[(3,5-difluoro-4-methoxyphenyl)methyl]pyrazol-3-yl]-2-[4-(dimethylamino)phenyl]acetamide
CID 118560290
2-[4-(dimethylamino)phenyl]-N-[1-[[4-(trifluoromethoxy)phenyl]methyl]pyrazol-3-yl]acetamide
CID 118560399
4-methoxy-N-[4-({4-oxo-2H,4H,5H-pyrazolo[3,4-d]pyrimidin-2-yl}methyl)phenyl]benzamide
CID 135869417
5-Amino-1-(4-methoxybenzoyl)pyrazole-4-carbonitrile
CID 2405928
N-[1-[(4-fluorophenyl)methyl]-3-pyrazolyl]-5-methyl-2-furancarboxamide
CID 841204
N-[1-(3-methylbenzyl)-1H-pyrazol-3-yl]-1,3-benzodioxole-5-carboxamide
CID 1510954
ethyl 5-[(4-methoxybenzoyl)amino]-1-{2-[(4-methoxybenzoyl)oxy]ethyl}-1H-pyrazole-4-carboxylate
CID 12005146
3-[2-(2-methoxyphenyl)ethyl]-5-[(2S)-1-methoxypropan-2-yl]oxy-N-(1-methylpyrazol-3-yl)benzamide
CID 67305655
3-[2-(4-fluorophenyl)ethyl]-5-[(2S)-1-methoxypropan-2-yl]oxy-N-(1-methylpyrazol-3-yl)benzamide
CID 67305810
3-[2-(2,4-difluorophenyl)ethyl]-5-[(2S)-1-methoxypropan-2-yl]oxy-N-(1-methylpyrazol-3-yl)benzamide
CID 67306982
3-[2-(2-fluorophenyl)ethyl]-5-[(2S)-1-methoxypropan-2-yl]oxy-N-(1-methylpyrazol-3-yl)benzamide
CID 67307127
3-[(E)-2-(2-fluorophenyl)ethenyl]-5-[(2S)-1-methoxypropan-2-yl]oxy-N-(1-methylpyrazol-3-yl)benzamide
CID 71540510

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N-(1-ethylpyrazol-3-yl)benzamide?
The IUPAC name of 4-ethoxy-N-(1-ethylpyrazol-3-yl)benzamide (CID 35286442) is 4-ethoxy-N-(1-ethylpyrazol-3-yl)benzamide.
What is the SMILES notation for 4-ethoxy-N-(1-ethylpyrazol-3-yl)benzamide?
The canonical SMILES for 4-ethoxy-N-(1-ethylpyrazol-3-yl)benzamide is CCOc1ccc(C(=O)Nc2ccn(CC)n2)cc1.
What is the InChIKey of 4-ethoxy-N-(1-ethylpyrazol-3-yl)benzamide?
The InChIKey is PEVCYGJBNKKCEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-3-17-10-9-13(16-17)15-14(18)11-5-7-12(8-6-11)19-4-2/h5-10H,3-4H2,1-2H3,(H,15,16,18).
What are the key properties of 4-ethoxy-N-(1-ethylpyrazol-3-yl)benzamide?
4-ethoxy-N-(1-ethylpyrazol-3-yl)benzamide has a molecular weight of 259.31 g/mol, XLogP of 2.55, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N-(1-ethylpyrazol-3-yl)benzamide is sourced from PubChem (CID 35286442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).