3-[5-(pyridin-4-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]-1-pyrrolidin-1-ylpropan-1-one

C19H25N5O — CID 72885695

IUPAC3-[5-(pyridin-4-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]-1-pyrrolidin-1-ylpropan-1-one
SMILESO=C(CCc1cc2n(n1)CCN(Cc1ccncc1)C2)N1CCCC1
InChIInChI=1S/C19H25N5O/c25-19(23-9-1-2-10-23)4-3-17-13-18-15-22(11-12-24(18)21-17)14-16-5-7-20-8-6-16/h5-8,13H,1-4,9-12,14-15H2
InChIKeyJRLGTTGKOJPFCB-UHFFFAOYSA-N
MW339.44 g/mol
LogP1.85
Rot. Bonds5

About 3-[5-(pyridin-4-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]-1-pyrrolidin-1-ylpropan-1-one

3-[5-(pyridin-4-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]-1-pyrrolidin-1-ylpropan-1-one (PubChem CID 72885695) has the molecular formula C19H25N5O and a molecular weight of 339.44 g/mol. Its IUPAC name is 3-[5-(pyridin-4-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]-1-pyrrolidin-1-ylpropan-1-one.

Molecular Properties

Compound Name3-[5-(pyridin-4-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]-1-pyrrolidin-1-ylpropan-1-one
PubChem CID72885695
Molecular FormulaC19H25N5O
Molecular Weight339.44 g/mol
Exact Mass339.21
IUPAC Name3-[5-(pyridin-4-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]-1-pyrrolidin-1-ylpropan-1-one
SMILESO=C(CCc1cc2n(n1)CCN(Cc1ccncc1)C2)N1CCCC1
InChIInChI=1S/C19H25N5O/c25-19(23-9-1-2-10-23)4-3-17-13-18-15-22(11-12-24(18)21-17)14-16-5-7-20-8-6-16/h5-8,13H,1-4,9-12,14-15H2
InChIKeyJRLGTTGKOJPFCB-UHFFFAOYSA-N
XLogP1.85
TPSA54.26 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 3-[5-(pyridin-4-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]-1-pyrrolidin-1-ylpropan-1-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-[5-(pyridin-4-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]-1-pyrrolidin-1-ylpropan-1-one?
The IUPAC name of 3-[5-(pyridin-4-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]-1-pyrrolidin-1-ylpropan-1-one (CID 72885695) is 3-[5-(pyridin-4-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]-1-pyrrolidin-1-ylpropan-1-one.
What is the SMILES notation for 3-[5-(pyridin-4-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]-1-pyrrolidin-1-ylpropan-1-one?
The canonical SMILES for 3-[5-(pyridin-4-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]-1-pyrrolidin-1-ylpropan-1-one is O=C(CCc1cc2n(n1)CCN(Cc1ccncc1)C2)N1CCCC1.
What is the InChIKey of 3-[5-(pyridin-4-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]-1-pyrrolidin-1-ylpropan-1-one?
The InChIKey is JRLGTTGKOJPFCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O/c25-19(23-9-1-2-10-23)4-3-17-13-18-15-22(11-12-24(18)21-17)14-16-5-7-20-8-6-16/h5-8,13H,1-4,9-12,14-15H2.
What are the key properties of 3-[5-(pyridin-4-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]-1-pyrrolidin-1-ylpropan-1-one?
3-[5-(pyridin-4-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]-1-pyrrolidin-1-ylpropan-1-one has a molecular weight of 339.44 g/mol, XLogP of 1.85, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-(pyridin-4-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]-1-pyrrolidin-1-ylpropan-1-one is sourced from PubChem (CID 72885695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).