N-[1-(2-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-1-oxopropan-2-yl]propanamide

C19H24N4O2 — CID 74239335

IUPACN-[1-(2-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-1-oxopropan-2-yl]propanamide
SMILESCCC(=O)NC(C)C(=O)N1CCn2nc(Cc3ccccc3)cc2C1
InChIInChI=1S/C19H24N4O2/c1-3-18(24)20-14(2)19(25)22-9-10-23-17(13-22)12-16(21-23)11-15-7-5-4-6-8-15/h4-8,12,14H,3,9-11,13H2,1-2H3,(H,20,24)
InChIKeyOOQNPTWLJVSBJH-UHFFFAOYSA-N
MW340.43 g/mol
LogP1.73
Rot. Bonds5

About N-[1-(2-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-1-oxopropan-2-yl]propanamide

N-[1-(2-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-1-oxopropan-2-yl]propanamide (PubChem CID 74239335) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is N-[1-(2-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-1-oxopropan-2-yl]propanamide.

Molecular Properties

Compound NameN-[1-(2-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-1-oxopropan-2-yl]propanamide
PubChem CID74239335
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC NameN-[1-(2-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-1-oxopropan-2-yl]propanamide
SMILESCCC(=O)NC(C)C(=O)N1CCn2nc(Cc3ccccc3)cc2C1
InChIInChI=1S/C19H24N4O2/c1-3-18(24)20-14(2)19(25)22-9-10-23-17(13-22)12-16(21-23)11-15-7-5-4-6-8-15/h4-8,12,14H,3,9-11,13H2,1-2H3,(H,20,24)
InChIKeyOOQNPTWLJVSBJH-UHFFFAOYSA-N
XLogP1.73
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-(2-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-1-oxopropan-2-yl]propanamide?
The IUPAC name of N-[1-(2-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-1-oxopropan-2-yl]propanamide (CID 74239335) is N-[1-(2-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-1-oxopropan-2-yl]propanamide.
What is the SMILES notation for N-[1-(2-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-1-oxopropan-2-yl]propanamide?
The canonical SMILES for N-[1-(2-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-1-oxopropan-2-yl]propanamide is CCC(=O)NC(C)C(=O)N1CCn2nc(Cc3ccccc3)cc2C1.
What is the InChIKey of N-[1-(2-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-1-oxopropan-2-yl]propanamide?
The InChIKey is OOQNPTWLJVSBJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-3-18(24)20-14(2)19(25)22-9-10-23-17(13-22)12-16(21-23)11-15-7-5-4-6-8-15/h4-8,12,14H,3,9-11,13H2,1-2H3,(H,20,24).
What are the key properties of N-[1-(2-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-1-oxopropan-2-yl]propanamide?
N-[1-(2-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-1-oxopropan-2-yl]propanamide has a molecular weight of 340.43 g/mol, XLogP of 1.73, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-1-oxopropan-2-yl]propanamide is sourced from PubChem (CID 74239335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).