N-(5-ethyl-1H-pyrazol-3-yl)-2-(3-methoxyphenyl)acetamide

C14H17N3O2 — CID 47423285

IUPACN-(5-ethyl-1H-pyrazol-3-yl)-2-(3-methoxyphenyl)acetamide
SMILESCCc1cc(NC(=O)Cc2cccc(OC)c2)n[nH]1
InChIInChI=1S/C14H17N3O2/c1-3-11-9-13(17-16-11)15-14(18)8-10-5-4-6-12(7-10)19-2/h4-7,9H,3,8H2,1-2H3,(H2,15,16,17,18)
InChIKeyFNNZKSLUBVPHAV-UHFFFAOYSA-N
MW259.31 g/mol
LogP2.16
Rot. Bonds5

About N-(5-ethyl-1H-pyrazol-3-yl)-2-(3-methoxyphenyl)acetamide

N-(5-ethyl-1H-pyrazol-3-yl)-2-(3-methoxyphenyl)acetamide (PubChem CID 47423285) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is N-(5-ethyl-1H-pyrazol-3-yl)-2-(3-methoxyphenyl)acetamide.

Molecular Properties

Compound NameN-(5-ethyl-1H-pyrazol-3-yl)-2-(3-methoxyphenyl)acetamide
PubChem CID47423285
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC NameN-(5-ethyl-1H-pyrazol-3-yl)-2-(3-methoxyphenyl)acetamide
SMILESCCc1cc(NC(=O)Cc2cccc(OC)c2)n[nH]1
InChIInChI=1S/C14H17N3O2/c1-3-11-9-13(17-16-11)15-14(18)8-10-5-4-6-12(7-10)19-2/h4-7,9H,3,8H2,1-2H3,(H2,15,16,17,18)
InChIKeyFNNZKSLUBVPHAV-UHFFFAOYSA-N
XLogP2.16
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(5-ethyl-1H-pyrazol-3-yl)-2-(3-methoxyphenyl)acetamide?
The IUPAC name of N-(5-ethyl-1H-pyrazol-3-yl)-2-(3-methoxyphenyl)acetamide (CID 47423285) is N-(5-ethyl-1H-pyrazol-3-yl)-2-(3-methoxyphenyl)acetamide.
What is the SMILES notation for N-(5-ethyl-1H-pyrazol-3-yl)-2-(3-methoxyphenyl)acetamide?
The canonical SMILES for N-(5-ethyl-1H-pyrazol-3-yl)-2-(3-methoxyphenyl)acetamide is CCc1cc(NC(=O)Cc2cccc(OC)c2)n[nH]1.
What is the InChIKey of N-(5-ethyl-1H-pyrazol-3-yl)-2-(3-methoxyphenyl)acetamide?
The InChIKey is FNNZKSLUBVPHAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-3-11-9-13(17-16-11)15-14(18)8-10-5-4-6-12(7-10)19-2/h4-7,9H,3,8H2,1-2H3,(H2,15,16,17,18).
What are the key properties of N-(5-ethyl-1H-pyrazol-3-yl)-2-(3-methoxyphenyl)acetamide?
N-(5-ethyl-1H-pyrazol-3-yl)-2-(3-methoxyphenyl)acetamide has a molecular weight of 259.31 g/mol, XLogP of 2.16, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-ethyl-1H-pyrazol-3-yl)-2-(3-methoxyphenyl)acetamide is sourced from PubChem (CID 47423285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).