(2-cyclopropylindazol-5-yl)boronic acid

C10H11BN2O2 — CID 155893680

IUPAC(2-cyclopropylindazol-5-yl)boronic acid
SMILESOB(O)c1ccc2nn(C3CC3)cc2c1
InChIInChI=1S/C10H11BN2O2/c14-11(15)8-1-4-10-7(5-8)6-13(12-10)9-2-3-9/h1,4-6,9,14-15H,2-3H2
InChIKeyZZNLOGYMVPEUCO-UHFFFAOYSA-N
MW202.02 g/mol
LogP0.05
Rot. Bonds2

About (2-cyclopropylindazol-5-yl)boronic acid

(2-cyclopropylindazol-5-yl)boronic acid (PubChem CID 155893680) has the molecular formula C10H11BN2O2 and a molecular weight of 202.02 g/mol. Its IUPAC name is (2-cyclopropylindazol-5-yl)boronic acid.

Molecular Properties

Compound Name(2-cyclopropylindazol-5-yl)boronic acid
PubChem CID155893680
Molecular FormulaC10H11BN2O2
Molecular Weight202.02 g/mol
Exact Mass202.09
IUPAC Name(2-cyclopropylindazol-5-yl)boronic acid
SMILESOB(O)c1ccc2nn(C3CC3)cc2c1
InChIInChI=1S/C10H11BN2O2/c14-11(15)8-1-4-10-7(5-8)6-13(12-10)9-2-3-9/h1,4-6,9,14-15H,2-3H2
InChIKeyZZNLOGYMVPEUCO-UHFFFAOYSA-N
XLogP0.05
TPSA58.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.02
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

2-Methyl-2H-indazol-6-amine
CID 590220
1-benzyl-1H-indazole
CID 797066
2-Methyl-5-nitro-2H-indazole
CID 97550
2-Methyl-6-nitro-2H-indazole
CID 81289
(2S)-1-(6-fluoroindazol-1-yl)propan-2-amine
CID 9859429
1-Methyl-1H-indazole
CID 139456
1-methyl-1H-indazol-5-amine
CID 2768032
2-(2H-indazol-2-yl)acetic acid
CID 12252435
(S)-1-(5-Fluoro-1H-indazol-1-yl)propan-2-amine
CID 44452853
1-Phenyl-1H-indazole
CID 304268
2-benzyl-5-nitro-2H-indazole
CID 4653102
3-(1H-indazol-1-yl)propanoic acid
CID 805922

Frequently Asked Questions

What is the IUPAC name of (2-cyclopropylindazol-5-yl)boronic acid?
The IUPAC name of (2-cyclopropylindazol-5-yl)boronic acid (CID 155893680) is (2-cyclopropylindazol-5-yl)boronic acid.
What is the SMILES notation for (2-cyclopropylindazol-5-yl)boronic acid?
The canonical SMILES for (2-cyclopropylindazol-5-yl)boronic acid is OB(O)c1ccc2nn(C3CC3)cc2c1.
What is the InChIKey of (2-cyclopropylindazol-5-yl)boronic acid?
The InChIKey is ZZNLOGYMVPEUCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11BN2O2/c14-11(15)8-1-4-10-7(5-8)6-13(12-10)9-2-3-9/h1,4-6,9,14-15H,2-3H2.
What are the key properties of (2-cyclopropylindazol-5-yl)boronic acid?
(2-cyclopropylindazol-5-yl)boronic acid has a molecular weight of 202.02 g/mol, XLogP of 0.05, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclopropylindazol-5-yl)boronic acid is sourced from PubChem (CID 155893680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).