2-cyclopentyl-N-[1-(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)-3-(furan-2-yl)pyrazol-5-yl]acetamide

C20H23N5O3 — CID 136614933

About 2-cyclopentyl-N-[1-(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)-3-(furan-2-yl)pyrazol-5-yl]acetamide

2-cyclopentyl-N-[1-(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)-3-(furan-2-yl)pyrazol-5-yl]acetamide (PubChem CID 136614933) has the molecular formula C20H23N5O3 and a molecular weight of 381.44 g/mol. Its IUPAC name is 2-cyclopentyl-N-[1-(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)-3-(furan-2-yl)pyrazol-5-yl]acetamide.

Molecular Properties

• Compound Name: 2-cyclopentyl-N-[1-(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)-3-(furan-2-yl)pyrazol-5-yl]acetamide
• PubChem CID: 136614933
• Molecular Formula: C20H23N5O3
• Molecular Weight: 381.44 g/mol
• Exact Mass: 381.18
• IUPAC Name: 2-cyclopentyl-N-[1-(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)-3-(furan-2-yl)pyrazol-5-yl]acetamide
• SMILES: Cc1nc(-n2nc(-c3ccco3)cc2NC(=O)CC2CCCC2)[nH]c(=O)c1C
• InChI: InChI=1S/C20H23N5O3/c1-12-13(2)21-20(23-19(12)27)25-17(11-15(24-25)16-8-5-9-28-16)22-18(26)10-14-6-3-4-7-14/h5,8-9,11,14H,3-4,6-7,10H2,1-2H3,(H,22,26)(H,21,23,27)
• InChIKey: YVOFPIBTSZVWMK-UHFFFAOYSA-N
• XLogP: 3.35
• TPSA: 105.81 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 6
• Rotatable Bonds: 5
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	381.44
LogP ≤ 5	3.35
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-N-[1-(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)-3-(furan-2-yl)pyrazol-5-yl]acetamide?

The IUPAC name of 2-cyclopentyl-N-[1-(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)-3-(furan-2-yl)pyrazol-5-yl]acetamide (CID 136614933) is 2-cyclopentyl-N-[1-(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)-3-(furan-2-yl)pyrazol-5-yl]acetamide.

What is the SMILES notation for 2-cyclopentyl-N-[1-(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)-3-(furan-2-yl)pyrazol-5-yl]acetamide?

The canonical SMILES for 2-cyclopentyl-N-[1-(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)-3-(furan-2-yl)pyrazol-5-yl]acetamide is Cc1nc(-n2nc(-c3ccco3)cc2NC(=O)CC2CCCC2)[nH]c(=O)c1C.

What is the InChIKey of 2-cyclopentyl-N-[1-(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)-3-(furan-2-yl)pyrazol-5-yl]acetamide?

The InChIKey is YVOFPIBTSZVWMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5O3/c1-12-13(2)21-20(23-19(12)27)25-17(11-15(24-25)16-8-5-9-28-16)22-18(26)10-14-6-3-4-7-14/h5,8-9,11,14H,3-4,6-7,10H2,1-2H3,(H,22,26)(H,21,23,27).

What are the key properties of 2-cyclopentyl-N-[1-(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)-3-(furan-2-yl)pyrazol-5-yl]acetamide?

2-cyclopentyl-N-[1-(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)-3-(furan-2-yl)pyrazol-5-yl]acetamide has a molecular weight of 381.44 g/mol, XLogP of 3.35, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 2-cyclopentyl-N-[1-(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)-3-(furan-2-yl)pyrazol-5-yl]acetamide is sourced from PubChem (CID 136614933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).