N-[(1-cyclopentyl-5-thiophen-2-ylpyrazol-3-yl)methyl]acetamide

C15H19N3OS — CID 71797442

IUPACN-[(1-cyclopentyl-5-thiophen-2-ylpyrazol-3-yl)methyl]acetamide
SMILESCC(=O)NCc1cc(-c2cccs2)n(C2CCCC2)n1
InChIInChI=1S/C15H19N3OS/c1-11(19)16-10-12-9-14(15-7-4-8-20-15)18(17-12)13-5-2-3-6-13/h4,7-9,13H,2-3,5-6,10H2,1H3,(H,16,19)
InChIKeyUDNQXWYFMZDDDV-UHFFFAOYSA-N
MW289.40 g/mol
LogP3.36
Rot. Bonds4

About N-[(1-cyclopentyl-5-thiophen-2-ylpyrazol-3-yl)methyl]acetamide

N-[(1-cyclopentyl-5-thiophen-2-ylpyrazol-3-yl)methyl]acetamide (PubChem CID 71797442) has the molecular formula C15H19N3OS and a molecular weight of 289.40 g/mol. Its IUPAC name is N-[(1-cyclopentyl-5-thiophen-2-ylpyrazol-3-yl)methyl]acetamide.

Molecular Properties

Compound NameN-[(1-cyclopentyl-5-thiophen-2-ylpyrazol-3-yl)methyl]acetamide
PubChem CID71797442
Molecular FormulaC15H19N3OS
Molecular Weight289.40 g/mol
Exact Mass289.12
IUPAC NameN-[(1-cyclopentyl-5-thiophen-2-ylpyrazol-3-yl)methyl]acetamide
SMILESCC(=O)NCc1cc(-c2cccs2)n(C2CCCC2)n1
InChIInChI=1S/C15H19N3OS/c1-11(19)16-10-12-9-14(15-7-4-8-20-15)18(17-12)13-5-2-3-6-13/h4,7-9,13H,2-3,5-6,10H2,1H3,(H,16,19)
InChIKeyUDNQXWYFMZDDDV-UHFFFAOYSA-N
XLogP3.36
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.40
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(1-cyclopentyl-5-thiophen-2-ylpyrazol-3-yl)methyl]acetamide?
The IUPAC name of N-[(1-cyclopentyl-5-thiophen-2-ylpyrazol-3-yl)methyl]acetamide (CID 71797442) is N-[(1-cyclopentyl-5-thiophen-2-ylpyrazol-3-yl)methyl]acetamide.
What is the SMILES notation for N-[(1-cyclopentyl-5-thiophen-2-ylpyrazol-3-yl)methyl]acetamide?
The canonical SMILES for N-[(1-cyclopentyl-5-thiophen-2-ylpyrazol-3-yl)methyl]acetamide is CC(=O)NCc1cc(-c2cccs2)n(C2CCCC2)n1.
What is the InChIKey of N-[(1-cyclopentyl-5-thiophen-2-ylpyrazol-3-yl)methyl]acetamide?
The InChIKey is UDNQXWYFMZDDDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3OS/c1-11(19)16-10-12-9-14(15-7-4-8-20-15)18(17-12)13-5-2-3-6-13/h4,7-9,13H,2-3,5-6,10H2,1H3,(H,16,19).
What are the key properties of N-[(1-cyclopentyl-5-thiophen-2-ylpyrazol-3-yl)methyl]acetamide?
N-[(1-cyclopentyl-5-thiophen-2-ylpyrazol-3-yl)methyl]acetamide has a molecular weight of 289.40 g/mol, XLogP of 3.36, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-cyclopentyl-5-thiophen-2-ylpyrazol-3-yl)methyl]acetamide is sourced from PubChem (CID 71797442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).