2-methyl-N-[(1R)-5-[5-(1-methylcyclopropyl)-1,2,4-oxadiazol-3-yl]-2,3-dihydro-1H-inden-1-yl]pyrazole-3-carboxamide

C20H21N5O2 — CID 139412625

About 2-methyl-N-[(1R)-5-[5-(1-methylcyclopropyl)-1,2,4-oxadiazol-3-yl]-2,3-dihydro-1H-inden-1-yl]pyrazole-3-carboxamide

2-methyl-N-[(1R)-5-[5-(1-methylcyclopropyl)-1,2,4-oxadiazol-3-yl]-2,3-dihydro-1H-inden-1-yl]pyrazole-3-carboxamide (PubChem CID 139412625) has the molecular formula C20H21N5O2 and a molecular weight of 363.42 g/mol. Its IUPAC name is 2-methyl-N-[(1R)-5-[5-(1-methylcyclopropyl)-1,2,4-oxadiazol-3-yl]-2,3-dihydro-1H-inden-1-yl]pyrazole-3-carboxamide.

Molecular Properties

• Compound Name: 2-methyl-N-[(1R)-5-[5-(1-methylcyclopropyl)-1,2,4-oxadiazol-3-yl]-2,3-dihydro-1H-inden-1-yl]pyrazole-3-carboxamide
• PubChem CID: 139412625
• Molecular Formula: C20H21N5O2
• Molecular Weight: 363.42 g/mol
• Exact Mass: 363.17
• IUPAC Name: 2-methyl-N-[(1R)-5-[5-(1-methylcyclopropyl)-1,2,4-oxadiazol-3-yl]-2,3-dihydro-1H-inden-1-yl]pyrazole-3-carboxamide
• SMILES: Cn1nccc1C(=O)N[C@@H]1CCc2cc(-c3noc(C4(C)CC4)n3)ccc21
• InChI: InChI=1S/C20H21N5O2/c1-20(8-9-20)19-23-17(24-27-19)13-3-5-14-12(11-13)4-6-15(14)22-18(26)16-7-10-21-25(16)2/h3,5,7,10-11,15H,4,6,8-9H2,1-2H3,(H,22,26)/t15-/m1/s1
• InChIKey: CVUJSIHRXQVQMO-OAHLLOKOSA-N
• XLogP: 2.94
• TPSA: 85.84 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 4
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	363.42
LogP ≤ 5	2.94
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(1R)-5-[5-(1-methylcyclopropyl)-1,2,4-oxadiazol-3-yl]-2,3-dihydro-1H-inden-1-yl]pyrazole-3-carboxamide?

The IUPAC name of 2-methyl-N-[(1R)-5-[5-(1-methylcyclopropyl)-1,2,4-oxadiazol-3-yl]-2,3-dihydro-1H-inden-1-yl]pyrazole-3-carboxamide (CID 139412625) is 2-methyl-N-[(1R)-5-[5-(1-methylcyclopropyl)-1,2,4-oxadiazol-3-yl]-2,3-dihydro-1H-inden-1-yl]pyrazole-3-carboxamide.

What is the SMILES notation for 2-methyl-N-[(1R)-5-[5-(1-methylcyclopropyl)-1,2,4-oxadiazol-3-yl]-2,3-dihydro-1H-inden-1-yl]pyrazole-3-carboxamide?

The canonical SMILES for 2-methyl-N-[(1R)-5-[5-(1-methylcyclopropyl)-1,2,4-oxadiazol-3-yl]-2,3-dihydro-1H-inden-1-yl]pyrazole-3-carboxamide is Cn1nccc1C(=O)N[C@@H]1CCc2cc(-c3noc(C4(C)CC4)n3)ccc21.

What is the InChIKey of 2-methyl-N-[(1R)-5-[5-(1-methylcyclopropyl)-1,2,4-oxadiazol-3-yl]-2,3-dihydro-1H-inden-1-yl]pyrazole-3-carboxamide?

The InChIKey is CVUJSIHRXQVQMO-OAHLLOKOSA-N. The full InChI is InChI=1S/C20H21N5O2/c1-20(8-9-20)19-23-17(24-27-19)13-3-5-14-12(11-13)4-6-15(14)22-18(26)16-7-10-21-25(16)2/h3,5,7,10-11,15H,4,6,8-9H2,1-2H3,(H,22,26)/t15-/m1/s1.

What are the key properties of 2-methyl-N-[(1R)-5-[5-(1-methylcyclopropyl)-1,2,4-oxadiazol-3-yl]-2,3-dihydro-1H-inden-1-yl]pyrazole-3-carboxamide?

2-methyl-N-[(1R)-5-[5-(1-methylcyclopropyl)-1,2,4-oxadiazol-3-yl]-2,3-dihydro-1H-inden-1-yl]pyrazole-3-carboxamide has a molecular weight of 363.42 g/mol, XLogP of 2.94, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 2-methyl-N-[(1R)-5-[5-(1-methylcyclopropyl)-1,2,4-oxadiazol-3-yl]-2,3-dihydro-1H-inden-1-yl]pyrazole-3-carboxamide is sourced from PubChem (CID 139412625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).