2-naphthalen-1-yl-N-[2-(1H-pyrazol-5-yl)thiophen-3-yl]acetamide

C19H15N3OS — CID 46869075

IUPAC2-naphthalen-1-yl-N-[2-(1H-pyrazol-5-yl)thiophen-3-yl]acetamide
SMILESO=C(Cc1cccc2ccccc12)Nc1ccsc1-c1ccn[nH]1
InChIInChI=1S/C19H15N3OS/c23-18(12-14-6-3-5-13-4-1-2-7-15(13)14)21-16-9-11-24-19(16)17-8-10-20-22-17/h1-11H,12H2,(H,20,22)(H,21,23)
InChIKeyRAIUWRMGPSZDJL-UHFFFAOYSA-N
MW333.42 g/mol
LogP4.47
Rot. Bonds4

About 2-naphthalen-1-yl-N-[2-(1H-pyrazol-5-yl)thiophen-3-yl]acetamide

2-naphthalen-1-yl-N-[2-(1H-pyrazol-5-yl)thiophen-3-yl]acetamide (PubChem CID 46869075) has the molecular formula C19H15N3OS and a molecular weight of 333.42 g/mol. Its IUPAC name is 2-naphthalen-1-yl-N-[2-(1H-pyrazol-5-yl)thiophen-3-yl]acetamide.

Molecular Properties

Compound Name2-naphthalen-1-yl-N-[2-(1H-pyrazol-5-yl)thiophen-3-yl]acetamide
PubChem CID46869075
Molecular FormulaC19H15N3OS
Molecular Weight333.42 g/mol
Exact Mass333.09
IUPAC Name2-naphthalen-1-yl-N-[2-(1H-pyrazol-5-yl)thiophen-3-yl]acetamide
SMILESO=C(Cc1cccc2ccccc12)Nc1ccsc1-c1ccn[nH]1
InChIInChI=1S/C19H15N3OS/c23-18(12-14-6-3-5-13-4-1-2-7-15(13)14)21-16-9-11-24-19(16)17-8-10-20-22-17/h1-11H,12H2,(H,20,22)(H,21,23)
InChIKeyRAIUWRMGPSZDJL-UHFFFAOYSA-N
XLogP4.47
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.42
LogP ≤ 54.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-1-yl-N-[2-(1H-pyrazol-5-yl)thiophen-3-yl]acetamide?
The IUPAC name of 2-naphthalen-1-yl-N-[2-(1H-pyrazol-5-yl)thiophen-3-yl]acetamide (CID 46869075) is 2-naphthalen-1-yl-N-[2-(1H-pyrazol-5-yl)thiophen-3-yl]acetamide.
What is the SMILES notation for 2-naphthalen-1-yl-N-[2-(1H-pyrazol-5-yl)thiophen-3-yl]acetamide?
The canonical SMILES for 2-naphthalen-1-yl-N-[2-(1H-pyrazol-5-yl)thiophen-3-yl]acetamide is O=C(Cc1cccc2ccccc12)Nc1ccsc1-c1ccn[nH]1.
What is the InChIKey of 2-naphthalen-1-yl-N-[2-(1H-pyrazol-5-yl)thiophen-3-yl]acetamide?
The InChIKey is RAIUWRMGPSZDJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N3OS/c23-18(12-14-6-3-5-13-4-1-2-7-15(13)14)21-16-9-11-24-19(16)17-8-10-20-22-17/h1-11H,12H2,(H,20,22)(H,21,23).
What are the key properties of 2-naphthalen-1-yl-N-[2-(1H-pyrazol-5-yl)thiophen-3-yl]acetamide?
2-naphthalen-1-yl-N-[2-(1H-pyrazol-5-yl)thiophen-3-yl]acetamide has a molecular weight of 333.42 g/mol, XLogP of 4.47, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-1-yl-N-[2-(1H-pyrazol-5-yl)thiophen-3-yl]acetamide is sourced from PubChem (CID 46869075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).