N-(2-morpholin-4-ylethyl)-5-oxo-4H-pyrazolo[1,5-a]quinazoline-3-carboxamide

C17H19N5O3 — CID 135965923

IUPACN-(2-morpholin-4-ylethyl)-5-oxo-4H-pyrazolo[1,5-a]quinazoline-3-carboxamide
SMILESO=C(NCCN1CCOCC1)c1cnn2c1[nH]c(=O)c1ccccc12
InChIInChI=1S/C17H19N5O3/c23-16(18-5-6-21-7-9-25-10-8-21)13-11-19-22-14-4-2-1-3-12(14)17(24)20-15(13)22/h1-4,11H,5-10H2,(H,18,23)(H,20,24)
InChIKeyXNYOOYGDOKWZAS-UHFFFAOYSA-N
MW341.37 g/mol
LogP0.24
Rot. Bonds4

About N-(2-morpholin-4-ylethyl)-5-oxo-4H-pyrazolo[1,5-a]quinazoline-3-carboxamide

N-(2-morpholin-4-ylethyl)-5-oxo-4H-pyrazolo[1,5-a]quinazoline-3-carboxamide (PubChem CID 135965923) has the molecular formula C17H19N5O3 and a molecular weight of 341.37 g/mol. Its IUPAC name is N-(2-morpholin-4-ylethyl)-5-oxo-4H-pyrazolo[1,5-a]quinazoline-3-carboxamide.

Molecular Properties

Compound NameN-(2-morpholin-4-ylethyl)-5-oxo-4H-pyrazolo[1,5-a]quinazoline-3-carboxamide
PubChem CID135965923
Molecular FormulaC17H19N5O3
Molecular Weight341.37 g/mol
Exact Mass341.15
IUPAC NameN-(2-morpholin-4-ylethyl)-5-oxo-4H-pyrazolo[1,5-a]quinazoline-3-carboxamide
SMILESO=C(NCCN1CCOCC1)c1cnn2c1[nH]c(=O)c1ccccc12
InChIInChI=1S/C17H19N5O3/c23-16(18-5-6-21-7-9-25-10-8-21)13-11-19-22-14-4-2-1-3-12(14)17(24)20-15(13)22/h1-4,11H,5-10H2,(H,18,23)(H,20,24)
InChIKeyXNYOOYGDOKWZAS-UHFFFAOYSA-N
XLogP0.24
TPSA91.73 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.37
LogP ≤ 50.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylethyl)-5-oxo-4H-pyrazolo[1,5-a]quinazoline-3-carboxamide?
The IUPAC name of N-(2-morpholin-4-ylethyl)-5-oxo-4H-pyrazolo[1,5-a]quinazoline-3-carboxamide (CID 135965923) is N-(2-morpholin-4-ylethyl)-5-oxo-4H-pyrazolo[1,5-a]quinazoline-3-carboxamide.
What is the SMILES notation for N-(2-morpholin-4-ylethyl)-5-oxo-4H-pyrazolo[1,5-a]quinazoline-3-carboxamide?
The canonical SMILES for N-(2-morpholin-4-ylethyl)-5-oxo-4H-pyrazolo[1,5-a]quinazoline-3-carboxamide is O=C(NCCN1CCOCC1)c1cnn2c1[nH]c(=O)c1ccccc12.
What is the InChIKey of N-(2-morpholin-4-ylethyl)-5-oxo-4H-pyrazolo[1,5-a]quinazoline-3-carboxamide?
The InChIKey is XNYOOYGDOKWZAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N5O3/c23-16(18-5-6-21-7-9-25-10-8-21)13-11-19-22-14-4-2-1-3-12(14)17(24)20-15(13)22/h1-4,11H,5-10H2,(H,18,23)(H,20,24).
What are the key properties of N-(2-morpholin-4-ylethyl)-5-oxo-4H-pyrazolo[1,5-a]quinazoline-3-carboxamide?
N-(2-morpholin-4-ylethyl)-5-oxo-4H-pyrazolo[1,5-a]quinazoline-3-carboxamide has a molecular weight of 341.37 g/mol, XLogP of 0.24, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylethyl)-5-oxo-4H-pyrazolo[1,5-a]quinazoline-3-carboxamide is sourced from PubChem (CID 135965923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).