2-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-N-[(1S)-5-methyl-2,3-dihydro-1H-inden-1-yl]acetamide

C23H26N4O2 — CID 70817506

IUPAC2-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-N-[(1S)-5-methyl-2,3-dihydro-1H-inden-1-yl]acetamide
SMILESCc1ccc2c(c1)CC[C@@H]2NC(=O)COc1cc(C)c2c(C3CC3)nn(C)c2n1
InChIInChI=1S/C23H26N4O2/c1-13-4-8-17-16(10-13)7-9-18(17)24-19(28)12-29-20-11-14(2)21-22(15-5-6-15)26-27(3)23(21)25-20/h4,8,10-11,15,18H,5-7,9,12H2,1-3H3,(H,24,28)/t18-/m0/s1
InChIKeyLADVEYKZADVBJM-SFHVURJKSA-N
MW390.49 g/mol
LogP3.65
Rot. Bonds5

About 2-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-N-[(1S)-5-methyl-2,3-dihydro-1H-inden-1-yl]acetamide

2-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-N-[(1S)-5-methyl-2,3-dihydro-1H-inden-1-yl]acetamide (PubChem CID 70817506) has the molecular formula C23H26N4O2 and a molecular weight of 390.49 g/mol. Its IUPAC name is 2-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-N-[(1S)-5-methyl-2,3-dihydro-1H-inden-1-yl]acetamide.

Molecular Properties

Compound Name2-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-N-[(1S)-5-methyl-2,3-dihydro-1H-inden-1-yl]acetamide
PubChem CID70817506
Molecular FormulaC23H26N4O2
Molecular Weight390.49 g/mol
Exact Mass390.21
IUPAC Name2-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-N-[(1S)-5-methyl-2,3-dihydro-1H-inden-1-yl]acetamide
SMILESCc1ccc2c(c1)CC[C@@H]2NC(=O)COc1cc(C)c2c(C3CC3)nn(C)c2n1
InChIInChI=1S/C23H26N4O2/c1-13-4-8-17-16(10-13)7-9-18(17)24-19(28)12-29-20-11-14(2)21-22(15-5-6-15)26-27(3)23(21)25-20/h4,8,10-11,15,18H,5-7,9,12H2,1-3H3,(H,24,28)/t18-/m0/s1
InChIKeyLADVEYKZADVBJM-SFHVURJKSA-N
XLogP3.65
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.49
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-N-[(1S)-5-methyl-2,3-dihydro-1H-inden-1-yl]acetamide?
The IUPAC name of 2-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-N-[(1S)-5-methyl-2,3-dihydro-1H-inden-1-yl]acetamide (CID 70817506) is 2-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-N-[(1S)-5-methyl-2,3-dihydro-1H-inden-1-yl]acetamide.
What is the SMILES notation for 2-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-N-[(1S)-5-methyl-2,3-dihydro-1H-inden-1-yl]acetamide?
The canonical SMILES for 2-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-N-[(1S)-5-methyl-2,3-dihydro-1H-inden-1-yl]acetamide is Cc1ccc2c(c1)CC[C@@H]2NC(=O)COc1cc(C)c2c(C3CC3)nn(C)c2n1.
What is the InChIKey of 2-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-N-[(1S)-5-methyl-2,3-dihydro-1H-inden-1-yl]acetamide?
The InChIKey is LADVEYKZADVBJM-SFHVURJKSA-N. The full InChI is InChI=1S/C23H26N4O2/c1-13-4-8-17-16(10-13)7-9-18(17)24-19(28)12-29-20-11-14(2)21-22(15-5-6-15)26-27(3)23(21)25-20/h4,8,10-11,15,18H,5-7,9,12H2,1-3H3,(H,24,28)/t18-/m0/s1.
What are the key properties of 2-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-N-[(1S)-5-methyl-2,3-dihydro-1H-inden-1-yl]acetamide?
2-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-N-[(1S)-5-methyl-2,3-dihydro-1H-inden-1-yl]acetamide has a molecular weight of 390.49 g/mol, XLogP of 3.65, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-cyclopropyl-1,4-dimethylpyrazolo[5,4-b]pyridin-6-yl)oxy-N-[(1S)-5-methyl-2,3-dihydro-1H-inden-1-yl]acetamide is sourced from PubChem (CID 70817506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).