N-(3,3-difluorocyclobutyl)-2-[5-[(2,5-dimethylpyrazol-3-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]acetamide

C18H24F2N6O — CID 131646485

IUPACN-(3,3-difluorocyclobutyl)-2-[5-[(2,5-dimethylpyrazol-3-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]acetamide
SMILESCc1cc(CN2Cc3ccnn3C(CC(=O)NC3CC(F)(F)C3)C2)n(C)n1
InChIInChI=1S/C18H24F2N6O/c1-12-5-15(24(2)23-12)10-25-9-14-3-4-21-26(14)16(11-25)6-17(27)22-13-7-18(19,20)8-13/h3-5,13,16H,6-11H2,1-2H3,(H,22,27)
InChIKeyGZZJLDBOVAWLKV-UHFFFAOYSA-N
MW378.43 g/mol
LogP1.79
Rot. Bonds5

About N-(3,3-difluorocyclobutyl)-2-[5-[(2,5-dimethylpyrazol-3-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]acetamide

N-(3,3-difluorocyclobutyl)-2-[5-[(2,5-dimethylpyrazol-3-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]acetamide (PubChem CID 131646485) has the molecular formula C18H24F2N6O and a molecular weight of 378.43 g/mol. Its IUPAC name is N-(3,3-difluorocyclobutyl)-2-[5-[(2,5-dimethylpyrazol-3-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]acetamide.

Molecular Properties

Compound NameN-(3,3-difluorocyclobutyl)-2-[5-[(2,5-dimethylpyrazol-3-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]acetamide
PubChem CID131646485
Molecular FormulaC18H24F2N6O
Molecular Weight378.43 g/mol
Exact Mass378.20
IUPAC NameN-(3,3-difluorocyclobutyl)-2-[5-[(2,5-dimethylpyrazol-3-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]acetamide
SMILESCc1cc(CN2Cc3ccnn3C(CC(=O)NC3CC(F)(F)C3)C2)n(C)n1
InChIInChI=1S/C18H24F2N6O/c1-12-5-15(24(2)23-12)10-25-9-14-3-4-21-26(14)16(11-25)6-17(27)22-13-7-18(19,20)8-13/h3-5,13,16H,6-11H2,1-2H3,(H,22,27)
InChIKeyGZZJLDBOVAWLKV-UHFFFAOYSA-N
XLogP1.79
TPSA67.98 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.43
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(3,3-difluorocyclobutyl)-2-[5-[(2,5-dimethylpyrazol-3-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]acetamide with MolForge

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Related Compounds

2-[5-[(2,5-dimethylpyrazol-3-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]-N,N-diethylethanamine;bis(2,2,2-trifluoroacetic acid)
CID 155863622
N-methyl-2-[5-[(6-methyl-2-pyridinyl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]acetamide
CID 131677306
N-methyl-2-[5-[(1-methylpyrazol-4-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]acetamide
CID 131677897
N-methyl-2-[5-[(4-methylphenyl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]acetamide;2,2,2-trifluoroacetic acid
CID 155860747
N-cyclobutyl-2-[5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]acetamide;2,2,2-trifluoroacetic acid
CID 155863742
2-[5-[(3,4-difluorophenyl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]-N-methylacetamide;2,2,2-trifluoroacetic acid
CID 155861561
N-cyclopropyl-2-[(7S)-5-(quinolin-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]acetamide
CID 124793121
N-methyl-2-[5-(pyridin-3-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]acetamide
CID 131677523
2-[5-[(4-ethylphenyl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]-N-methylacetamide;2,2,2-trifluoroacetic acid
CID 155861975
N-(3,3-difluorocyclobutyl)-5-[(2-methoxyphenyl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide
CID 133136590
1-[5-[(2,5-dimethylpyrazol-3-yl)methyl]-4,6,7,8-tetrahydropyrazolo[1,5-a][1,4]diazepin-7-yl]-N,N-dimethylmethanamine;bis(2,2,2-trifluoroacetic acid)
CID 155844510
N-(cyclopropylmethyl)-2-[5-[(5-methyl-1,2-oxazol-3-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]acetamide
CID 131641559

Frequently Asked Questions

What is the IUPAC name of N-(3,3-difluorocyclobutyl)-2-[5-[(2,5-dimethylpyrazol-3-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]acetamide?
The IUPAC name of N-(3,3-difluorocyclobutyl)-2-[5-[(2,5-dimethylpyrazol-3-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]acetamide (CID 131646485) is N-(3,3-difluorocyclobutyl)-2-[5-[(2,5-dimethylpyrazol-3-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]acetamide.
What is the SMILES notation for N-(3,3-difluorocyclobutyl)-2-[5-[(2,5-dimethylpyrazol-3-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]acetamide?
The canonical SMILES for N-(3,3-difluorocyclobutyl)-2-[5-[(2,5-dimethylpyrazol-3-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]acetamide is Cc1cc(CN2Cc3ccnn3C(CC(=O)NC3CC(F)(F)C3)C2)n(C)n1.
What is the InChIKey of N-(3,3-difluorocyclobutyl)-2-[5-[(2,5-dimethylpyrazol-3-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]acetamide?
The InChIKey is GZZJLDBOVAWLKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24F2N6O/c1-12-5-15(24(2)23-12)10-25-9-14-3-4-21-26(14)16(11-25)6-17(27)22-13-7-18(19,20)8-13/h3-5,13,16H,6-11H2,1-2H3,(H,22,27).
What are the key properties of N-(3,3-difluorocyclobutyl)-2-[5-[(2,5-dimethylpyrazol-3-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]acetamide?
N-(3,3-difluorocyclobutyl)-2-[5-[(2,5-dimethylpyrazol-3-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]acetamide has a molecular weight of 378.43 g/mol, XLogP of 1.79, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-difluorocyclobutyl)-2-[5-[(2,5-dimethylpyrazol-3-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]acetamide is sourced from PubChem (CID 131646485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).