4-(6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carbonyl)-1H-quinolin-2-one

C16H14N4O2 — CID 155963104

IUPAC4-(6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carbonyl)-1H-quinolin-2-one
SMILESO=C(c1cc(=O)[nH]c2ccccc12)N1CCn2nccc2C1
InChIInChI=1S/C16H14N4O2/c21-15-9-13(12-3-1-2-4-14(12)18-15)16(22)19-7-8-20-11(10-19)5-6-17-20/h1-6,9H,7-8,10H2,(H,18,21)
InChIKeyPOEJPKJWDHNSIS-UHFFFAOYSA-N
MW294.31 g/mol
LogP1.38
Rot. Bonds1

About 4-(6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carbonyl)-1H-quinolin-2-one

4-(6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carbonyl)-1H-quinolin-2-one (PubChem CID 155963104) has the molecular formula C16H14N4O2 and a molecular weight of 294.31 g/mol. Its IUPAC name is 4-(6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carbonyl)-1H-quinolin-2-one.

Molecular Properties

Compound Name4-(6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carbonyl)-1H-quinolin-2-one
PubChem CID155963104
Molecular FormulaC16H14N4O2
Molecular Weight294.31 g/mol
Exact Mass294.11
IUPAC Name4-(6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carbonyl)-1H-quinolin-2-one
SMILESO=C(c1cc(=O)[nH]c2ccccc12)N1CCn2nccc2C1
InChIInChI=1S/C16H14N4O2/c21-15-9-13(12-3-1-2-4-14(12)18-15)16(22)19-7-8-20-11(10-19)5-6-17-20/h1-6,9H,7-8,10H2,(H,18,21)
InChIKeyPOEJPKJWDHNSIS-UHFFFAOYSA-N
XLogP1.38
TPSA70.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.31
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carbonyl)-1H-quinolin-2-one?
The IUPAC name of 4-(6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carbonyl)-1H-quinolin-2-one (CID 155963104) is 4-(6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carbonyl)-1H-quinolin-2-one.
What is the SMILES notation for 4-(6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carbonyl)-1H-quinolin-2-one?
The canonical SMILES for 4-(6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carbonyl)-1H-quinolin-2-one is O=C(c1cc(=O)[nH]c2ccccc12)N1CCn2nccc2C1.
What is the InChIKey of 4-(6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carbonyl)-1H-quinolin-2-one?
The InChIKey is POEJPKJWDHNSIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N4O2/c21-15-9-13(12-3-1-2-4-14(12)18-15)16(22)19-7-8-20-11(10-19)5-6-17-20/h1-6,9H,7-8,10H2,(H,18,21).
What are the key properties of 4-(6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carbonyl)-1H-quinolin-2-one?
4-(6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carbonyl)-1H-quinolin-2-one has a molecular weight of 294.31 g/mol, XLogP of 1.38, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carbonyl)-1H-quinolin-2-one is sourced from PubChem (CID 155963104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).