N-[(1R)-2,3-dihydro-1H-inden-1-yl]-6-(2,5-dimethylfuran-3-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide

C25H26N4O2 — CID 26246644

IUPACN-[(1R)-2,3-dihydro-1H-inden-1-yl]-6-(2,5-dimethylfuran-3-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCc1cc(-c2cc(C(=O)N[C@@H]3CCc4ccccc43)c3cnn(C(C)C)c3n2)c(C)o1
InChIInChI=1S/C25H26N4O2/c1-14(2)29-24-21(13-26-29)20(12-23(27-24)19-11-15(3)31-16(19)4)25(30)28-22-10-9-17-7-5-6-8-18(17)22/h5-8,11-14,22H,9-10H2,1-4H3,(H,28,30)/t22-/m1/s1
InChIKeyYOKNCQVYQSZSOP-JOCHJYFZSA-N
MW414.51 g/mol
LogP5.31
Rot. Bonds4

About N-[(1R)-2,3-dihydro-1H-inden-1-yl]-6-(2,5-dimethylfuran-3-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide

N-[(1R)-2,3-dihydro-1H-inden-1-yl]-6-(2,5-dimethylfuran-3-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 26246644) has the molecular formula C25H26N4O2 and a molecular weight of 414.51 g/mol. Its IUPAC name is N-[(1R)-2,3-dihydro-1H-inden-1-yl]-6-(2,5-dimethylfuran-3-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[(1R)-2,3-dihydro-1H-inden-1-yl]-6-(2,5-dimethylfuran-3-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
PubChem CID26246644
Molecular FormulaC25H26N4O2
Molecular Weight414.51 g/mol
Exact Mass414.21
IUPAC NameN-[(1R)-2,3-dihydro-1H-inden-1-yl]-6-(2,5-dimethylfuran-3-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCc1cc(-c2cc(C(=O)N[C@@H]3CCc4ccccc43)c3cnn(C(C)C)c3n2)c(C)o1
InChIInChI=1S/C25H26N4O2/c1-14(2)29-24-21(13-26-29)20(12-23(27-24)19-11-15(3)31-16(19)4)25(30)28-22-10-9-17-7-5-6-8-18(17)22/h5-8,11-14,22H,9-10H2,1-4H3,(H,28,30)/t22-/m1/s1
InChIKeyYOKNCQVYQSZSOP-JOCHJYFZSA-N
XLogP5.31
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500414.51
LogP ≤ 55.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(1R)-2,3-dihydro-1H-inden-1-yl]-6-(2,5-dimethylfuran-3-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide with MolForge

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Related Compounds

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N-[1-[6-(2,5-dimethylfuran-3-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carbonyl]piperidin-4-yl]benzamide
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Frequently Asked Questions

What is the IUPAC name of N-[(1R)-2,3-dihydro-1H-inden-1-yl]-6-(2,5-dimethylfuran-3-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
The IUPAC name of N-[(1R)-2,3-dihydro-1H-inden-1-yl]-6-(2,5-dimethylfuran-3-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide (CID 26246644) is N-[(1R)-2,3-dihydro-1H-inden-1-yl]-6-(2,5-dimethylfuran-3-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide.
What is the SMILES notation for N-[(1R)-2,3-dihydro-1H-inden-1-yl]-6-(2,5-dimethylfuran-3-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
The canonical SMILES for N-[(1R)-2,3-dihydro-1H-inden-1-yl]-6-(2,5-dimethylfuran-3-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide is Cc1cc(-c2cc(C(=O)N[C@@H]3CCc4ccccc43)c3cnn(C(C)C)c3n2)c(C)o1.
What is the InChIKey of N-[(1R)-2,3-dihydro-1H-inden-1-yl]-6-(2,5-dimethylfuran-3-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
The InChIKey is YOKNCQVYQSZSOP-JOCHJYFZSA-N. The full InChI is InChI=1S/C25H26N4O2/c1-14(2)29-24-21(13-26-29)20(12-23(27-24)19-11-15(3)31-16(19)4)25(30)28-22-10-9-17-7-5-6-8-18(17)22/h5-8,11-14,22H,9-10H2,1-4H3,(H,28,30)/t22-/m1/s1.
What are the key properties of N-[(1R)-2,3-dihydro-1H-inden-1-yl]-6-(2,5-dimethylfuran-3-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
N-[(1R)-2,3-dihydro-1H-inden-1-yl]-6-(2,5-dimethylfuran-3-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 414.51 g/mol, XLogP of 5.31, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-2,3-dihydro-1H-inden-1-yl]-6-(2,5-dimethylfuran-3-yl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 26246644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).