2-[(7R)-5-cyclobutyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]-N-(furan-2-ylmethyl)acetamide

C17H22N4O2 — CID 124793453

IUPAC2-[(7R)-5-cyclobutyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]-N-(furan-2-ylmethyl)acetamide
SMILESO=C(C[C@@H]1CN(C2CCC2)Cc2ccnn21)NCc1ccco1
InChIInChI=1S/C17H22N4O2/c22-17(18-10-16-5-2-8-23-16)9-15-12-20(13-3-1-4-13)11-14-6-7-19-21(14)15/h2,5-8,13,15H,1,3-4,9-12H2,(H,18,22)/t15-/m1/s1
InChIKeyNOQIARKQKAFVQJ-OAHLLOKOSA-N
MW314.39 g/mol
LogP2.09
Rot. Bonds5

About 2-[(7R)-5-cyclobutyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]-N-(furan-2-ylmethyl)acetamide

2-[(7R)-5-cyclobutyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]-N-(furan-2-ylmethyl)acetamide (PubChem CID 124793453) has the molecular formula C17H22N4O2 and a molecular weight of 314.39 g/mol. Its IUPAC name is 2-[(7R)-5-cyclobutyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]-N-(furan-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-[(7R)-5-cyclobutyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]-N-(furan-2-ylmethyl)acetamide
PubChem CID124793453
Molecular FormulaC17H22N4O2
Molecular Weight314.39 g/mol
Exact Mass314.17
IUPAC Name2-[(7R)-5-cyclobutyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]-N-(furan-2-ylmethyl)acetamide
SMILESO=C(C[C@@H]1CN(C2CCC2)Cc2ccnn21)NCc1ccco1
InChIInChI=1S/C17H22N4O2/c22-17(18-10-16-5-2-8-23-16)9-15-12-20(13-3-1-4-13)11-14-6-7-19-21(14)15/h2,5-8,13,15H,1,3-4,9-12H2,(H,18,22)/t15-/m1/s1
InChIKeyNOQIARKQKAFVQJ-OAHLLOKOSA-N
XLogP2.09
TPSA63.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.39
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(furan-2-ylmethyl)-2-[5-(2-methylcyclopropanecarbonyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]acetamide
CID 131693643
2-[(7R)-5-cyclopentyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]-N-(pyridin-3-ylmethyl)acetamide
CID 124791578
N-(furan-2-ylmethyl)-2-[(7S)-5-[(3-methylthiophen-2-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]acetamide
CID 124912511
2-[(7R)-5-cyclopentyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]-1-morpholin-4-ylethanone
CID 124790894
2-[[N-(1-cyclopentylpyrrolidin-3-yl)-N'-methylcarbamimidoyl]amino]-N-(furan-2-ylmethyl)acetamide
CID 111918531
N-[2-[(7S)-5-cyclopentyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]ethyl]-1-methylpyrrole-2-carboxamide
CID 124818888
N-[2-(5-cyclobutyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl)ethyl]thiophene-3-carboxamide
CID 131659331
2-(azetidin-3-yl)-N-(furan-2-ylmethyl)acetamide
CID 64616126
2-[3-(cyclopentylmethyl)-3-azabicyclo[3.3.1]nonan-9-yl]-N-(furan-2-ylmethyl)acetamide
CID 155870941
N-[2-[5-(furan-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]ethyl]-3-methylbutanamide
CID 131677947
2-(cyclohexylamino)-N-(furan-2-ylmethyl)acetamide
CID 54816411
2-(3,4-dihydroxypyrrolidin-1-yl)-N-(furan-2-ylmethyl)acetamide
CID 106672810

Frequently Asked Questions

What is the IUPAC name of 2-[(7R)-5-cyclobutyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]-N-(furan-2-ylmethyl)acetamide?
The IUPAC name of 2-[(7R)-5-cyclobutyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]-N-(furan-2-ylmethyl)acetamide (CID 124793453) is 2-[(7R)-5-cyclobutyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]-N-(furan-2-ylmethyl)acetamide.
What is the SMILES notation for 2-[(7R)-5-cyclobutyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]-N-(furan-2-ylmethyl)acetamide?
The canonical SMILES for 2-[(7R)-5-cyclobutyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]-N-(furan-2-ylmethyl)acetamide is O=C(C[C@@H]1CN(C2CCC2)Cc2ccnn21)NCc1ccco1.
What is the InChIKey of 2-[(7R)-5-cyclobutyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]-N-(furan-2-ylmethyl)acetamide?
The InChIKey is NOQIARKQKAFVQJ-OAHLLOKOSA-N. The full InChI is InChI=1S/C17H22N4O2/c22-17(18-10-16-5-2-8-23-16)9-15-12-20(13-3-1-4-13)11-14-6-7-19-21(14)15/h2,5-8,13,15H,1,3-4,9-12H2,(H,18,22)/t15-/m1/s1.
What are the key properties of 2-[(7R)-5-cyclobutyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]-N-(furan-2-ylmethyl)acetamide?
2-[(7R)-5-cyclobutyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]-N-(furan-2-ylmethyl)acetamide has a molecular weight of 314.39 g/mol, XLogP of 2.09, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(7R)-5-cyclobutyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]-N-(furan-2-ylmethyl)acetamide is sourced from PubChem (CID 124793453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).