N-(1-cyclopropylpyrazol-3-yl)sulfonyl-2-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide

C23H24N4O4S — CID 153337688

About N-(1-cyclopropylpyrazol-3-yl)sulfonyl-2-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide

N-(1-cyclopropylpyrazol-3-yl)sulfonyl-2-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide (PubChem CID 153337688) has the molecular formula C23H24N4O4S and a molecular weight of 452.54 g/mol. Its IUPAC name is N-(1-cyclopropylpyrazol-3-yl)sulfonyl-2-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide.

Molecular Properties

• Compound Name: N-(1-cyclopropylpyrazol-3-yl)sulfonyl-2-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide
• PubChem CID: 153337688
• Molecular Formula: C23H24N4O4S
• Molecular Weight: 452.54 g/mol
• Exact Mass: 452.15
• IUPAC Name: N-(1-cyclopropylpyrazol-3-yl)sulfonyl-2-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide
• SMILES: COc1cc(-c2ccc3c(c2CC(=O)NS(=O)(=O)c2ccn(C4CC4)n2)CCC3)ccn1
• InChI: InChI=1S/C23H24N4O4S/c1-31-22-13-16(9-11-24-22)19-8-5-15-3-2-4-18(15)20(19)14-21(28)26-32(29,30)23-10-12-27(25-23)17-6-7-17/h5,8-13,17H,2-4,6-7,14H2,1H3,(H,26,28)
• InChIKey: ZYERXTPJTVBDSQ-UHFFFAOYSA-N
• XLogP: 2.82
• TPSA: 103.18 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 7
• Heavy Atoms: 32
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	452.54
LogP ≤ 5	2.82
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylpyrazol-3-yl)sulfonyl-2-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide?

The IUPAC name of N-(1-cyclopropylpyrazol-3-yl)sulfonyl-2-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide (CID 153337688) is N-(1-cyclopropylpyrazol-3-yl)sulfonyl-2-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide.

What is the SMILES notation for N-(1-cyclopropylpyrazol-3-yl)sulfonyl-2-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide?

The canonical SMILES for N-(1-cyclopropylpyrazol-3-yl)sulfonyl-2-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide is COc1cc(-c2ccc3c(c2CC(=O)NS(=O)(=O)c2ccn(C4CC4)n2)CCC3)ccn1.

What is the InChIKey of N-(1-cyclopropylpyrazol-3-yl)sulfonyl-2-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide?

The InChIKey is ZYERXTPJTVBDSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O4S/c1-31-22-13-16(9-11-24-22)19-8-5-15-3-2-4-18(15)20(19)14-21(28)26-32(29,30)23-10-12-27(25-23)17-6-7-17/h5,8-13,17H,2-4,6-7,14H2,1H3,(H,26,28).

What are the key properties of N-(1-cyclopropylpyrazol-3-yl)sulfonyl-2-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide?

N-(1-cyclopropylpyrazol-3-yl)sulfonyl-2-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide has a molecular weight of 452.54 g/mol, XLogP of 2.82, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for N-(1-cyclopropylpyrazol-3-yl)sulfonyl-2-[5-(2-methoxy-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide is sourced from PubChem (CID 153337688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).