2-cyclopentyl-N-[3-[(4-fluorophenyl)methyl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]acetamide

C21H23FN4O — CID 68750441

IUPAC2-cyclopentyl-N-[3-[(4-fluorophenyl)methyl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]acetamide
SMILESCc1cnc2c(Cc3ccc(F)cc3)c(NC(=O)CC3CCCC3)nn2c1
InChIInChI=1S/C21H23FN4O/c1-14-12-23-21-18(10-16-6-8-17(22)9-7-16)20(25-26(21)13-14)24-19(27)11-15-4-2-3-5-15/h6-9,12-13,15H,2-5,10-11H2,1H3,(H,24,25,27)
InChIKeyIWLZLKNDRVCYFU-UHFFFAOYSA-N
MW366.44 g/mol
LogP4.29
Rot. Bonds5

About 2-cyclopentyl-N-[3-[(4-fluorophenyl)methyl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]acetamide

2-cyclopentyl-N-[3-[(4-fluorophenyl)methyl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]acetamide (PubChem CID 68750441) has the molecular formula C21H23FN4O and a molecular weight of 366.44 g/mol. Its IUPAC name is 2-cyclopentyl-N-[3-[(4-fluorophenyl)methyl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]acetamide.

Molecular Properties

Compound Name2-cyclopentyl-N-[3-[(4-fluorophenyl)methyl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]acetamide
PubChem CID68750441
Molecular FormulaC21H23FN4O
Molecular Weight366.44 g/mol
Exact Mass366.19
IUPAC Name2-cyclopentyl-N-[3-[(4-fluorophenyl)methyl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]acetamide
SMILESCc1cnc2c(Cc3ccc(F)cc3)c(NC(=O)CC3CCCC3)nn2c1
InChIInChI=1S/C21H23FN4O/c1-14-12-23-21-18(10-16-6-8-17(22)9-7-16)20(25-26(21)13-14)24-19(27)11-15-4-2-3-5-15/h6-9,12-13,15H,2-5,10-11H2,1H3,(H,24,25,27)
InChIKeyIWLZLKNDRVCYFU-UHFFFAOYSA-N
XLogP4.29
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.44
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-cyclopentyl-N-[3-[(4-fluorophenyl)methyl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-N-[3-[(4-fluorophenyl)methyl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]acetamide?
The IUPAC name of 2-cyclopentyl-N-[3-[(4-fluorophenyl)methyl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]acetamide (CID 68750441) is 2-cyclopentyl-N-[3-[(4-fluorophenyl)methyl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]acetamide.
What is the SMILES notation for 2-cyclopentyl-N-[3-[(4-fluorophenyl)methyl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]acetamide?
The canonical SMILES for 2-cyclopentyl-N-[3-[(4-fluorophenyl)methyl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]acetamide is Cc1cnc2c(Cc3ccc(F)cc3)c(NC(=O)CC3CCCC3)nn2c1.
What is the InChIKey of 2-cyclopentyl-N-[3-[(4-fluorophenyl)methyl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]acetamide?
The InChIKey is IWLZLKNDRVCYFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23FN4O/c1-14-12-23-21-18(10-16-6-8-17(22)9-7-16)20(25-26(21)13-14)24-19(27)11-15-4-2-3-5-15/h6-9,12-13,15H,2-5,10-11H2,1H3,(H,24,25,27).
What are the key properties of 2-cyclopentyl-N-[3-[(4-fluorophenyl)methyl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]acetamide?
2-cyclopentyl-N-[3-[(4-fluorophenyl)methyl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]acetamide has a molecular weight of 366.44 g/mol, XLogP of 4.29, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-N-[3-[(4-fluorophenyl)methyl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]acetamide is sourced from PubChem (CID 68750441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).