2-pyrazolo[1,5-a]pyrazin-3-yl-3H-benzimidazole-5-carboxylic acid

C14H9N5O2 — CID 103119978

IUPAC2-pyrazolo[1,5-a]pyrazin-3-yl-3H-benzimidazole-5-carboxylic acid
SMILESO=C(O)c1ccc2nc(-c3cnn4ccncc34)[nH]c2c1
InChIInChI=1S/C14H9N5O2/c20-14(21)8-1-2-10-11(5-8)18-13(17-10)9-6-16-19-4-3-15-7-12(9)19/h1-7H,(H,17,18)(H,20,21)
InChIKeyXMVSIBNZYMAXRL-UHFFFAOYSA-N
MW279.26 g/mol
LogP1.97
Rot. Bonds2

About 2-pyrazolo[1,5-a]pyrazin-3-yl-3H-benzimidazole-5-carboxylic acid

2-pyrazolo[1,5-a]pyrazin-3-yl-3H-benzimidazole-5-carboxylic acid (PubChem CID 103119978) has the molecular formula C14H9N5O2 and a molecular weight of 279.26 g/mol. Its IUPAC name is 2-pyrazolo[1,5-a]pyrazin-3-yl-3H-benzimidazole-5-carboxylic acid.

Molecular Properties

Compound Name2-pyrazolo[1,5-a]pyrazin-3-yl-3H-benzimidazole-5-carboxylic acid
PubChem CID103119978
Molecular FormulaC14H9N5O2
Molecular Weight279.26 g/mol
Exact Mass279.08
IUPAC Name2-pyrazolo[1,5-a]pyrazin-3-yl-3H-benzimidazole-5-carboxylic acid
SMILESO=C(O)c1ccc2nc(-c3cnn4ccncc34)[nH]c2c1
InChIInChI=1S/C14H9N5O2/c20-14(21)8-1-2-10-11(5-8)18-13(17-10)9-6-16-19-4-3-15-7-12(9)19/h1-7H,(H,17,18)(H,20,21)
InChIKeyXMVSIBNZYMAXRL-UHFFFAOYSA-N
XLogP1.97
TPSA96.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.26
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-pyrazolo[1,5-a]pyrazin-3-yl-3H-benzimidazole-5-carboxylic acid 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

2-pyridin-4-yl-3H-benzimidazole-5-carboxylic acid
CID 2771800
2-pyrazolo[1,5-a]pyridin-3-yl-3H-benzimidazol-5-ol
CID 103119924
2-[2-(1H-imidazol-2-yl)phenyl]-3H-benzimidazole-5-carboxylic acid
CID 11738240
2-(4-aminophenyl)-3H-benzimidazole-5-carboxylic acid
CID 774873
2-(2,3-dichlorophenyl)-3H-benzimidazole-5-carboxylic acid
CID 43349288
2-[3-(6-carboxy-1H-benzimidazol-2-yl)phenyl]-3H-benzimidazole-5-carboxylic acid;hydrochloride
CID 2728750
2-(3-carboxy-2,5-dihydroxyphenyl)-3H-benzimidazole-5-carboxylic acid
CID 156760820
2-(2-fluoro-5-methylphenyl)-3H-benzimidazole-5-carboxylic acid
CID 46990564
2-(2-methylsulfanylphenyl)-3H-benzimidazole-5-carboxylic acid
CID 79217746
2-(4-hydroxyphenyl)-3H-benzimidazole-5-carboxylic acid
CID 162148176
2-(2-morpholin-4-ylphenyl)-3H-benzimidazole-5-carboxylic acid
CID 67112516
2-(1H-benzimidazol-2-yl)terephthalic acid
CID 6395633

Frequently Asked Questions

What is the IUPAC name of 2-pyrazolo[1,5-a]pyrazin-3-yl-3H-benzimidazole-5-carboxylic acid?
The IUPAC name of 2-pyrazolo[1,5-a]pyrazin-3-yl-3H-benzimidazole-5-carboxylic acid (CID 103119978) is 2-pyrazolo[1,5-a]pyrazin-3-yl-3H-benzimidazole-5-carboxylic acid.
What is the SMILES notation for 2-pyrazolo[1,5-a]pyrazin-3-yl-3H-benzimidazole-5-carboxylic acid?
The canonical SMILES for 2-pyrazolo[1,5-a]pyrazin-3-yl-3H-benzimidazole-5-carboxylic acid is O=C(O)c1ccc2nc(-c3cnn4ccncc34)[nH]c2c1.
What is the InChIKey of 2-pyrazolo[1,5-a]pyrazin-3-yl-3H-benzimidazole-5-carboxylic acid?
The InChIKey is XMVSIBNZYMAXRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9N5O2/c20-14(21)8-1-2-10-11(5-8)18-13(17-10)9-6-16-19-4-3-15-7-12(9)19/h1-7H,(H,17,18)(H,20,21).
What are the key properties of 2-pyrazolo[1,5-a]pyrazin-3-yl-3H-benzimidazole-5-carboxylic acid?
2-pyrazolo[1,5-a]pyrazin-3-yl-3H-benzimidazole-5-carboxylic acid has a molecular weight of 279.26 g/mol, XLogP of 1.97, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrazolo[1,5-a]pyrazin-3-yl-3H-benzimidazole-5-carboxylic acid is sourced from PubChem (CID 103119978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).