5-cyclopropyl-N-[2-[2-(2,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]-1H-pyrazole-3-carboxamide

C23H24N6O2 — CID 91892800

IUPAC5-cyclopropyl-N-[2-[2-(2,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]-1H-pyrazole-3-carboxamide
SMILESCc1ccc(-c2cc3c(=O)n(CCNC(=O)c4cc(C5CC5)[nH]n4)ccn3n2)c(C)c1
InChIInChI=1S/C23H24N6O2/c1-14-3-6-17(15(2)11-14)19-13-21-23(31)28(9-10-29(21)27-19)8-7-24-22(30)20-12-18(25-26-20)16-4-5-16/h3,6,9-13,16H,4-5,7-8H2,1-2H3,(H,24,30)(H,25,26)
InChIKeyABRUVQZOULGYGL-UHFFFAOYSA-N
MW416.49 g/mol
LogP2.81
Rot. Bonds6

About 5-cyclopropyl-N-[2-[2-(2,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]-1H-pyrazole-3-carboxamide

5-cyclopropyl-N-[2-[2-(2,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]-1H-pyrazole-3-carboxamide (PubChem CID 91892800) has the molecular formula C23H24N6O2 and a molecular weight of 416.49 g/mol. Its IUPAC name is 5-cyclopropyl-N-[2-[2-(2,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name5-cyclopropyl-N-[2-[2-(2,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]-1H-pyrazole-3-carboxamide
PubChem CID91892800
Molecular FormulaC23H24N6O2
Molecular Weight416.49 g/mol
Exact Mass416.20
IUPAC Name5-cyclopropyl-N-[2-[2-(2,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]-1H-pyrazole-3-carboxamide
SMILESCc1ccc(-c2cc3c(=O)n(CCNC(=O)c4cc(C5CC5)[nH]n4)ccn3n2)c(C)c1
InChIInChI=1S/C23H24N6O2/c1-14-3-6-17(15(2)11-14)19-13-21-23(31)28(9-10-29(21)27-19)8-7-24-22(30)20-12-18(25-26-20)16-4-5-16/h3,6,9-13,16H,4-5,7-8H2,1-2H3,(H,24,30)(H,25,26)
InChIKeyABRUVQZOULGYGL-UHFFFAOYSA-N
XLogP2.81
TPSA97.08 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.49
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[2-[2-(2,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]-4-fluorobenzamide
CID 91892782
N-[2-[2-(2,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]-2-(4-fluorophenyl)acetamide
CID 91892771
N-[2-[2-(2,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]-3,4-difluorobenzamide
CID 91892798
N-[2-[2-(2,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]furan-2-carboxamide
CID 91909242
N-[2-[2-(2,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]-3,4-dimethoxybenzamide
CID 91892789
N-[2-[2-(2,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]-2-(4-fluorophenoxy)acetamide
CID 91892775
N-[2-[2-(2,5-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]furan-3-carboxamide
CID 175667283
5-cyclopropyl-N-[3-(methylamino)propyl]-1H-pyrazole-3-carboxamide;hydrochloride
CID 119430091
2-[2-(2,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]-N'-hydroxyethanimidamide
CID 131632878
N-[2-[2-(3,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]quinoline-2-carboxamide
CID 91892847
5-cyclopropyl-N-[2-(methylamino)ethyl]-1H-pyrazole-3-carboxamide;hydrochloride
CID 119500515
N-[2-[2-(4-fluorophenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]-3-methylthiophene-2-carboxamide
CID 91892640

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-N-[2-[2-(2,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]-1H-pyrazole-3-carboxamide?
The IUPAC name of 5-cyclopropyl-N-[2-[2-(2,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]-1H-pyrazole-3-carboxamide (CID 91892800) is 5-cyclopropyl-N-[2-[2-(2,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 5-cyclopropyl-N-[2-[2-(2,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]-1H-pyrazole-3-carboxamide?
The canonical SMILES for 5-cyclopropyl-N-[2-[2-(2,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]-1H-pyrazole-3-carboxamide is Cc1ccc(-c2cc3c(=O)n(CCNC(=O)c4cc(C5CC5)[nH]n4)ccn3n2)c(C)c1.
What is the InChIKey of 5-cyclopropyl-N-[2-[2-(2,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]-1H-pyrazole-3-carboxamide?
The InChIKey is ABRUVQZOULGYGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N6O2/c1-14-3-6-17(15(2)11-14)19-13-21-23(31)28(9-10-29(21)27-19)8-7-24-22(30)20-12-18(25-26-20)16-4-5-16/h3,6,9-13,16H,4-5,7-8H2,1-2H3,(H,24,30)(H,25,26).
What are the key properties of 5-cyclopropyl-N-[2-[2-(2,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]-1H-pyrazole-3-carboxamide?
5-cyclopropyl-N-[2-[2-(2,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]-1H-pyrazole-3-carboxamide has a molecular weight of 416.49 g/mol, XLogP of 2.81, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-N-[2-[2-(2,4-dimethylphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5-yl]ethyl]-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 91892800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).