1-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-3-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]propan-2-one

C24H27N3O2 — CID 149184977

About 1-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-3-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]propan-2-one

1-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-3-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]propan-2-one (PubChem CID 149184977) has the molecular formula C24H27N3O2 and a molecular weight of 389.50 g/mol. Its IUPAC name is 1-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-3-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]propan-2-one.

Molecular Properties

• Compound Name: 1-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-3-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]propan-2-one
• PubChem CID: 149184977
• Molecular Formula: C24H27N3O2
• Molecular Weight: 389.50 g/mol
• Exact Mass: 389.21
• IUPAC Name: 1-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-3-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]propan-2-one
• SMILES: Cc1ccc2c(c1)CC[C@@H]2CC(=O)COc1cc(C)c2c(C3CC3)nn(C)c2n1
• InChI: InChI=1S/C24H27N3O2/c1-14-4-9-20-17(10-14)7-8-18(20)12-19(28)13-29-21-11-15(2)22-23(16-5-6-16)26-27(3)24(22)25-21/h4,9-11,16,18H,5-8,12-13H2,1-3H3/t18-/m1/s1
• InChIKey: XBRUSKNZHUUYOK-GOSISDBHSA-N
• XLogP: 4.53
• TPSA: 57.01 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 6
• Heavy Atoms: 29
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	389.50
LogP ≤ 5	4.53
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 1-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-3-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]propan-2-one?

The IUPAC name of 1-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-3-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]propan-2-one (CID 149184977) is 1-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-3-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]propan-2-one.

What is the SMILES notation for 1-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-3-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]propan-2-one?

The canonical SMILES for 1-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-3-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]propan-2-one is Cc1ccc2c(c1)CC[C@@H]2CC(=O)COc1cc(C)c2c(C3CC3)nn(C)c2n1.

What is the InChIKey of 1-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-3-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]propan-2-one?

The InChIKey is XBRUSKNZHUUYOK-GOSISDBHSA-N. The full InChI is InChI=1S/C24H27N3O2/c1-14-4-9-20-17(10-14)7-8-18(20)12-19(28)13-29-21-11-15(2)22-23(16-5-6-16)26-27(3)24(22)25-21/h4,9-11,16,18H,5-8,12-13H2,1-3H3/t18-/m1/s1.

What are the key properties of 1-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-3-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]propan-2-one?

1-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-3-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]propan-2-one has a molecular weight of 389.50 g/mol, XLogP of 4.53, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-3-[(1R)-5-methyl-2,3-dihydro-1H-inden-1-yl]propan-2-one is sourced from PubChem (CID 149184977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).