2-cyclopentyl-N-(5-ethyl-3-thiophen-2-yl-1H-pyrazol-4-yl)acetamide

C16H21N3OS — CID 42687227

IUPAC2-cyclopentyl-N-(5-ethyl-3-thiophen-2-yl-1H-pyrazol-4-yl)acetamide
SMILESCCc1[nH]nc(-c2cccs2)c1NC(=O)CC1CCCC1
InChIInChI=1S/C16H21N3OS/c1-2-12-15(16(19-18-12)13-8-5-9-21-13)17-14(20)10-11-6-3-4-7-11/h5,8-9,11H,2-4,6-7,10H2,1H3,(H,17,20)(H,18,19)
InChIKeySZQWLPLIZHNHMC-UHFFFAOYSA-N
MW303.43 g/mol
LogP4.22
Rot. Bonds5

About 2-cyclopentyl-N-(5-ethyl-3-thiophen-2-yl-1H-pyrazol-4-yl)acetamide

2-cyclopentyl-N-(5-ethyl-3-thiophen-2-yl-1H-pyrazol-4-yl)acetamide (PubChem CID 42687227) has the molecular formula C16H21N3OS and a molecular weight of 303.43 g/mol. Its IUPAC name is 2-cyclopentyl-N-(5-ethyl-3-thiophen-2-yl-1H-pyrazol-4-yl)acetamide.

Molecular Properties

Compound Name2-cyclopentyl-N-(5-ethyl-3-thiophen-2-yl-1H-pyrazol-4-yl)acetamide
PubChem CID42687227
Molecular FormulaC16H21N3OS
Molecular Weight303.43 g/mol
Exact Mass303.14
IUPAC Name2-cyclopentyl-N-(5-ethyl-3-thiophen-2-yl-1H-pyrazol-4-yl)acetamide
SMILESCCc1[nH]nc(-c2cccs2)c1NC(=O)CC1CCCC1
InChIInChI=1S/C16H21N3OS/c1-2-12-15(16(19-18-12)13-8-5-9-21-13)17-14(20)10-11-6-3-4-7-11/h5,8-9,11H,2-4,6-7,10H2,1H3,(H,17,20)(H,18,19)
InChIKeySZQWLPLIZHNHMC-UHFFFAOYSA-N
XLogP4.22
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.43
LogP ≤ 54.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-N-(5-ethyl-3-thiophen-2-yl-1H-pyrazol-4-yl)acetamide?
The IUPAC name of 2-cyclopentyl-N-(5-ethyl-3-thiophen-2-yl-1H-pyrazol-4-yl)acetamide (CID 42687227) is 2-cyclopentyl-N-(5-ethyl-3-thiophen-2-yl-1H-pyrazol-4-yl)acetamide.
What is the SMILES notation for 2-cyclopentyl-N-(5-ethyl-3-thiophen-2-yl-1H-pyrazol-4-yl)acetamide?
The canonical SMILES for 2-cyclopentyl-N-(5-ethyl-3-thiophen-2-yl-1H-pyrazol-4-yl)acetamide is CCc1[nH]nc(-c2cccs2)c1NC(=O)CC1CCCC1.
What is the InChIKey of 2-cyclopentyl-N-(5-ethyl-3-thiophen-2-yl-1H-pyrazol-4-yl)acetamide?
The InChIKey is SZQWLPLIZHNHMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3OS/c1-2-12-15(16(19-18-12)13-8-5-9-21-13)17-14(20)10-11-6-3-4-7-11/h5,8-9,11H,2-4,6-7,10H2,1H3,(H,17,20)(H,18,19).
What are the key properties of 2-cyclopentyl-N-(5-ethyl-3-thiophen-2-yl-1H-pyrazol-4-yl)acetamide?
2-cyclopentyl-N-(5-ethyl-3-thiophen-2-yl-1H-pyrazol-4-yl)acetamide has a molecular weight of 303.43 g/mol, XLogP of 4.22, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-N-(5-ethyl-3-thiophen-2-yl-1H-pyrazol-4-yl)acetamide is sourced from PubChem (CID 42687227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).