3-(piperazine-1-carbonyl)-4H-pyrazolo[1,5-a]quinazolin-5-one

C15H15N5O2 — CID 135925377

IUPAC3-(piperazine-1-carbonyl)-4H-pyrazolo[1,5-a]quinazolin-5-one
SMILESO=C(c1cnn2c1[nH]c(=O)c1ccccc12)N1CCNCC1
InChIInChI=1S/C15H15N5O2/c21-14-10-3-1-2-4-12(10)20-13(18-14)11(9-17-20)15(22)19-7-5-16-6-8-19/h1-4,9,16H,5-8H2,(H,18,21)
InChIKeyLCUJGCNZLWVEGL-UHFFFAOYSA-N
MW297.32 g/mol
LogP0.22
Rot. Bonds1

About 3-(piperazine-1-carbonyl)-4H-pyrazolo[1,5-a]quinazolin-5-one

3-(piperazine-1-carbonyl)-4H-pyrazolo[1,5-a]quinazolin-5-one (PubChem CID 135925377) has the molecular formula C15H15N5O2 and a molecular weight of 297.32 g/mol. Its IUPAC name is 3-(piperazine-1-carbonyl)-4H-pyrazolo[1,5-a]quinazolin-5-one.

Molecular Properties

Compound Name3-(piperazine-1-carbonyl)-4H-pyrazolo[1,5-a]quinazolin-5-one
PubChem CID135925377
Molecular FormulaC15H15N5O2
Molecular Weight297.32 g/mol
Exact Mass297.12
IUPAC Name3-(piperazine-1-carbonyl)-4H-pyrazolo[1,5-a]quinazolin-5-one
SMILESO=C(c1cnn2c1[nH]c(=O)c1ccccc12)N1CCNCC1
InChIInChI=1S/C15H15N5O2/c21-14-10-3-1-2-4-12(10)20-13(18-14)11(9-17-20)15(22)19-7-5-16-6-8-19/h1-4,9,16H,5-8H2,(H,18,21)
InChIKeyLCUJGCNZLWVEGL-UHFFFAOYSA-N
XLogP0.22
TPSA82.50 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.32
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-(1,4-diazepane-1-carbonyl)-4H-pyrazolo[1,5-a]quinazolin-5-one
CID 135965959
3-(azepane-1-carbonyl)-4H-pyrazolo[1,5-a]quinazolin-5-one
CID 135925375
3-[(2S)-2-methylpiperazine-1-carbonyl]-4H-pyrazolo[1,5-a]quinazolin-5-one;hydrochloride
CID 137127774
3-(imidazole-1-carbonyl)-4H-pyrazolo[1,5-a]quinazolin-5-one
CID 135925379
3-[3-(aminomethyl)piperidine-1-carbonyl]-4H-pyrazolo[1,5-a]quinazolin-5-one
CID 135925381
(2S)-1-(5-oxo-4H-pyrazolo[1,5-a]quinazoline-3-carbonyl)pyrrolidine-2-carboxylic acid
CID 136942108
5-oxo-N-[(3S)-piperidin-3-yl]-4H-pyrazolo[1,5-a]quinazoline-3-carboxamide
CID 137127730
3-[8-(2,5-dimethylphenyl)sulfonyl-2,8-diazaspiro[4.5]decane-2-carbonyl]-4H-pyrazolo[1,5-a]quinazolin-5-one
CID 135463124
N-benzyl-5-oxo-4H-pyrazolo[1,5-a]quinazoline-3-carboxamide
CID 135925373
2-[cyclopropyl-(5-oxo-4H-pyrazolo[1,5-a]quinazoline-3-carbonyl)amino]acetic acid
CID 136990430
2-cyclopropyl-2-[(5-oxo-4H-pyrazolo[1,5-a]quinazoline-3-carbonyl)amino]acetic acid
CID 136931713
N-[(2-hydroxycyclopentyl)methyl]-5-oxo-4H-pyrazolo[1,5-a]quinazoline-3-carboxamide
CID 136697105

Frequently Asked Questions

What is the IUPAC name of 3-(piperazine-1-carbonyl)-4H-pyrazolo[1,5-a]quinazolin-5-one?
The IUPAC name of 3-(piperazine-1-carbonyl)-4H-pyrazolo[1,5-a]quinazolin-5-one (CID 135925377) is 3-(piperazine-1-carbonyl)-4H-pyrazolo[1,5-a]quinazolin-5-one.
What is the SMILES notation for 3-(piperazine-1-carbonyl)-4H-pyrazolo[1,5-a]quinazolin-5-one?
The canonical SMILES for 3-(piperazine-1-carbonyl)-4H-pyrazolo[1,5-a]quinazolin-5-one is O=C(c1cnn2c1[nH]c(=O)c1ccccc12)N1CCNCC1.
What is the InChIKey of 3-(piperazine-1-carbonyl)-4H-pyrazolo[1,5-a]quinazolin-5-one?
The InChIKey is LCUJGCNZLWVEGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5O2/c21-14-10-3-1-2-4-12(10)20-13(18-14)11(9-17-20)15(22)19-7-5-16-6-8-19/h1-4,9,16H,5-8H2,(H,18,21).
What are the key properties of 3-(piperazine-1-carbonyl)-4H-pyrazolo[1,5-a]quinazolin-5-one?
3-(piperazine-1-carbonyl)-4H-pyrazolo[1,5-a]quinazolin-5-one has a molecular weight of 297.32 g/mol, XLogP of 0.22, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(piperazine-1-carbonyl)-4H-pyrazolo[1,5-a]quinazolin-5-one is sourced from PubChem (CID 135925377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).