7-methoxy-9-oxo-N-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazoline-2-carboxamide

C13H10N8O3 — CID 12724807

IUPAC7-methoxy-9-oxo-N-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazoline-2-carboxamide
SMILESCOc1ccc2nc3cc(C(=O)Nc4nn[nH]n4)[nH]n3c(=O)c2c1
InChIInChI=1S/C13H10N8O3/c1-24-6-2-3-8-7(4-6)12(23)21-10(14-8)5-9(18-21)11(22)15-13-16-19-20-17-13/h2-5,18H,1H3,(H2,15,16,17,19,20,22)
InChIKeyRXBIEJHPINJYLO-UHFFFAOYSA-N
MW326.28 g/mol
LogP-0.05
Rot. Bonds3

About 7-methoxy-9-oxo-N-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazoline-2-carboxamide

7-methoxy-9-oxo-N-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazoline-2-carboxamide (PubChem CID 12724807) has the molecular formula C13H10N8O3 and a molecular weight of 326.28 g/mol. Its IUPAC name is 7-methoxy-9-oxo-N-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazoline-2-carboxamide.

Molecular Properties

Compound Name7-methoxy-9-oxo-N-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazoline-2-carboxamide
PubChem CID12724807
Molecular FormulaC13H10N8O3
Molecular Weight326.28 g/mol
Exact Mass326.09
IUPAC Name7-methoxy-9-oxo-N-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazoline-2-carboxamide
SMILESCOc1ccc2nc3cc(C(=O)Nc4nn[nH]n4)[nH]n3c(=O)c2c1
InChIInChI=1S/C13H10N8O3/c1-24-6-2-3-8-7(4-6)12(23)21-10(14-8)5-9(18-21)11(22)15-13-16-19-20-17-13/h2-5,18H,1H3,(H2,15,16,17,19,20,22)
InChIKeyRXBIEJHPINJYLO-UHFFFAOYSA-N
XLogP-0.05
TPSA142.95 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.28
LogP ≤ 5-0.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

Analyze 7-methoxy-9-oxo-N-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazoline-2-carboxamide with MolForge

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Related Compounds

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CID 21491304
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CID 14673576
2-(4-methoxyphenyl)-4-methyl-N-(2H-tetrazol-5-yl)-1,3-thiazole-5-carboxamide
CID 14772776
6-(4-tert-butylphenyl)-4-methoxy-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide
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6-methoxy-3-(1-methoxyethoxy)-N-(2H-tetrazol-5-yl)-1-benzofuran-2-carboxamide
CID 139660274
6-(4-chlorophenyl)-4-methoxy-N-(2H-tetrazol-5-yl)pyridine-2-carboxamide
CID 12784865
3-cyclooctyloxy-5-methoxy-N-(2H-tetrazol-5-yl)-1-benzofuran-2-carboxamide
CID 11246122
2-methoxy-11-oxopyrido[2,1-b]quinazoline-7-carboxylic acid
CID 13052288
3-(3-acetamidophenoxy)-5-methoxy-N-(2H-tetrazol-5-yl)-1-benzothiophene-2-carboxamide
CID 91360519
N-[3-[(4-fluorophenyl)methyl]-2-methyl-4-oxoquinazolin-6-yl]-4-methoxybenzamide
CID 43813136
1-methoxy-4-oxo-N-(2H-tetrazol-5-yl)quinolizine-3-carboxamide
CID 15632117
CID 70528241
CID 70528241

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-9-oxo-N-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazoline-2-carboxamide?
The IUPAC name of 7-methoxy-9-oxo-N-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazoline-2-carboxamide (CID 12724807) is 7-methoxy-9-oxo-N-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazoline-2-carboxamide.
What is the SMILES notation for 7-methoxy-9-oxo-N-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazoline-2-carboxamide?
The canonical SMILES for 7-methoxy-9-oxo-N-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazoline-2-carboxamide is COc1ccc2nc3cc(C(=O)Nc4nn[nH]n4)[nH]n3c(=O)c2c1.
What is the InChIKey of 7-methoxy-9-oxo-N-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazoline-2-carboxamide?
The InChIKey is RXBIEJHPINJYLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N8O3/c1-24-6-2-3-8-7(4-6)12(23)21-10(14-8)5-9(18-21)11(22)15-13-16-19-20-17-13/h2-5,18H,1H3,(H2,15,16,17,19,20,22).
What are the key properties of 7-methoxy-9-oxo-N-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazoline-2-carboxamide?
7-methoxy-9-oxo-N-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazoline-2-carboxamide has a molecular weight of 326.28 g/mol, XLogP of -0.05, 3 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-9-oxo-N-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazoline-2-carboxamide is sourced from PubChem (CID 12724807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).