2-(2-hydrazinylbenzimidazol-1-yl)acetic acid

C9H10N4O2 — CID 2773162

IUPAC2-(2-hydrazinylbenzimidazol-1-yl)acetic acid
SMILESNNc1nc2ccccc2n1CC(=O)O
InChIInChI=1S/C9H10N4O2/c10-12-9-11-6-3-1-2-4-7(6)13(9)5-8(14)15/h1-4H,5,10H2,(H,11,12)(H,14,15)
InChIKeyWKQHOGPZSBGNFA-UHFFFAOYSA-N
MW206.21 g/mol
LogP0.41
Rot. Bonds3

About 2-(2-hydrazinylbenzimidazol-1-yl)acetic acid

2-(2-hydrazinylbenzimidazol-1-yl)acetic acid (PubChem CID 2773162) has the molecular formula C9H10N4O2 and a molecular weight of 206.21 g/mol. Its IUPAC name is 2-(2-hydrazinylbenzimidazol-1-yl)acetic acid.

Molecular Properties

Compound Name2-(2-hydrazinylbenzimidazol-1-yl)acetic acid
PubChem CID2773162
Molecular FormulaC9H10N4O2
Molecular Weight206.21 g/mol
Exact Mass206.08
IUPAC Name2-(2-hydrazinylbenzimidazol-1-yl)acetic acid
SMILESNNc1nc2ccccc2n1CC(=O)O
InChIInChI=1S/C9H10N4O2/c10-12-9-11-6-3-1-2-4-7(6)13(9)5-8(14)15/h1-4H,5,10H2,(H,11,12)(H,14,15)
InChIKeyWKQHOGPZSBGNFA-UHFFFAOYSA-N
XLogP0.41
TPSA93.17 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.21
LogP ≤ 50.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(2-anilinobenzimidazol-1-yl)acetic acid
CID 15944452
2-[2-(4-bromoanilino)benzimidazol-1-yl]acetic acid
CID 119027105
2-[2-(1H-pyrrol-2-ylamino)benzimidazol-1-yl]acetic acid
CID 115144069
2-[2-(cyclohexylamino)benzimidazol-1-yl]acetic acid
CID 43831374
2-(2-methylbenzimidazol-1-yl)acetic acid
CID 75530217
2-(2-phenylbenzimidazol-1-yl)acetic acid
CID 619876
(1-pentylbenzimidazol-2-yl)hydrazine
CID 4136867
2-(2-hydrazinylbenzimidazol-1-yl)acetonitrile
CID 83416613
2-[2-(1,1,2,2,2-pentafluoroethyl)benzimidazol-1-yl]acetic acid
CID 43248585
2-[2-(2-methylphenyl)benzimidazol-1-yl]acetic acid
CID 43349122
ethyl 2-[2-(methylamino)benzimidazol-1-yl]acetate
CID 10376688
2-[2-[tert-butyl(methyl)amino]benzimidazol-1-yl]acetic acid
CID 115144077

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydrazinylbenzimidazol-1-yl)acetic acid?
The IUPAC name of 2-(2-hydrazinylbenzimidazol-1-yl)acetic acid (CID 2773162) is 2-(2-hydrazinylbenzimidazol-1-yl)acetic acid.
What is the SMILES notation for 2-(2-hydrazinylbenzimidazol-1-yl)acetic acid?
The canonical SMILES for 2-(2-hydrazinylbenzimidazol-1-yl)acetic acid is NNc1nc2ccccc2n1CC(=O)O.
What is the InChIKey of 2-(2-hydrazinylbenzimidazol-1-yl)acetic acid?
The InChIKey is WKQHOGPZSBGNFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4O2/c10-12-9-11-6-3-1-2-4-7(6)13(9)5-8(14)15/h1-4H,5,10H2,(H,11,12)(H,14,15).
What are the key properties of 2-(2-hydrazinylbenzimidazol-1-yl)acetic acid?
2-(2-hydrazinylbenzimidazol-1-yl)acetic acid has a molecular weight of 206.21 g/mol, XLogP of 0.41, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydrazinylbenzimidazol-1-yl)acetic acid is sourced from PubChem (CID 2773162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).