2-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazolin-9-one

C11H7N7O — CID 12724799

IUPAC2-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazolin-9-one
SMILESO=c1c2ccccc2nc2cc(-c3nn[nH]n3)[nH]n12
InChIInChI=1S/C11H7N7O/c19-11-6-3-1-2-4-7(6)12-9-5-8(15-18(9)11)10-13-16-17-14-10/h1-5,15H,(H,13,14,16,17)
InChIKeyYZINHMMQBQNBMV-UHFFFAOYSA-N
MW253.23 g/mol
LogP0.36
Rot. Bonds1

About 2-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazolin-9-one

2-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazolin-9-one (PubChem CID 12724799) has the molecular formula C11H7N7O and a molecular weight of 253.23 g/mol. Its IUPAC name is 2-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazolin-9-one.

Molecular Properties

Compound Name2-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazolin-9-one
PubChem CID12724799
Molecular FormulaC11H7N7O
Molecular Weight253.23 g/mol
Exact Mass253.07
IUPAC Name2-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazolin-9-one
SMILESO=c1c2ccccc2nc2cc(-c3nn[nH]n3)[nH]n12
InChIInChI=1S/C11H7N7O/c19-11-6-3-1-2-4-7(6)12-9-5-8(15-18(9)11)10-13-16-17-14-10/h1-5,15H,(H,13,14,16,17)
InChIKeyYZINHMMQBQNBMV-UHFFFAOYSA-N
XLogP0.36
TPSA104.62 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.23
LogP ≤ 50.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazolin-9-one with MolForge

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

Launch Full Analysis

Related Compounds

5-methoxy-2-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazolin-9-one
CID 12724801
2-propyl-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]quinazolin-4-one
CID 19087824
5,7-dichloro-2-phenyl-1H-pyrazolo[5,1-b]quinazolin-9-one
CID 131845918
5,11-diphenyl-1,5,8,12-tetrazatricyclo[7.3.0.03,7]dodeca-3(7),8,10-triene-2,6-dione
CID 14867542
7-methoxy-9-oxo-N-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazoline-2-carboxamide
CID 12724807
2,5-diphenyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 2818800
2-(2-ethoxyphenyl)-3-[4-(2H-tetrazol-5-yl)phenyl]quinazolin-4-one
CID 90011394
N-[(4-methoxyphenyl)methyl]-2-(2H-tetrazol-5-yl)quinazolin-4-amine
CID 68518029
5-phenyl-2,6,7,11-tetrazatricyclo[7.4.0.03,7]trideca-1(9),2,4-trien-8-one
CID 53184078
3-(2H-tetrazol-5-yl)quinolin-2-amine
CID 175802338
5-phenyl-2,6,7,12-tetrazatricyclo[7.4.0.03,7]trideca-1(9),2,4-trien-8-one;hydrochloride
CID 155823406
5-methylquinolino[2,1-b]quinazolin-12-one
CID 14666352

Frequently Asked Questions

What is the IUPAC name of 2-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazolin-9-one?
The IUPAC name of 2-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazolin-9-one (CID 12724799) is 2-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazolin-9-one.
What is the SMILES notation for 2-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazolin-9-one?
The canonical SMILES for 2-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazolin-9-one is O=c1c2ccccc2nc2cc(-c3nn[nH]n3)[nH]n12.
What is the InChIKey of 2-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazolin-9-one?
The InChIKey is YZINHMMQBQNBMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7N7O/c19-11-6-3-1-2-4-7(6)12-9-5-8(15-18(9)11)10-13-16-17-14-10/h1-5,15H,(H,13,14,16,17).
What are the key properties of 2-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazolin-9-one?
2-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazolin-9-one has a molecular weight of 253.23 g/mol, XLogP of 0.36, 1 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazolin-9-one is sourced from PubChem (CID 12724799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).