5-(4-fluoro-1H-benzimidazol-2-yl)-1H-pyrazol-3-amine

C10H8FN5 — CID 135995632

IUPAC5-(4-fluoro-1H-benzimidazol-2-yl)-1H-pyrazol-3-amine
SMILESNc1cc(-c2nc3c(F)cccc3[nH]2)[nH]n1
InChIInChI=1S/C10H8FN5/c11-5-2-1-3-6-9(5)14-10(13-6)7-4-8(12)16-15-7/h1-4H,(H,13,14)(H3,12,15,16)
InChIKeyGIRQRMAMDFIEBN-UHFFFAOYSA-N
MW217.21 g/mol
LogP1.67
Rot. Bonds1

About 5-(4-fluoro-1H-benzimidazol-2-yl)-1H-pyrazol-3-amine

5-(4-fluoro-1H-benzimidazol-2-yl)-1H-pyrazol-3-amine (PubChem CID 135995632) has the molecular formula C10H8FN5 and a molecular weight of 217.21 g/mol. Its IUPAC name is 5-(4-fluoro-1H-benzimidazol-2-yl)-1H-pyrazol-3-amine.

Molecular Properties

Compound Name5-(4-fluoro-1H-benzimidazol-2-yl)-1H-pyrazol-3-amine
PubChem CID135995632
Molecular FormulaC10H8FN5
Molecular Weight217.21 g/mol
Exact Mass217.08
IUPAC Name5-(4-fluoro-1H-benzimidazol-2-yl)-1H-pyrazol-3-amine
SMILESNc1cc(-c2nc3c(F)cccc3[nH]2)[nH]n1
InChIInChI=1S/C10H8FN5/c11-5-2-1-3-6-9(5)14-10(13-6)7-4-8(12)16-15-7/h1-4H,(H,13,14)(H3,12,15,16)
InChIKeyGIRQRMAMDFIEBN-UHFFFAOYSA-N
XLogP1.67
TPSA83.38 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.21
LogP ≤ 51.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(4-fluoro-1H-benzimidazol-2-yl)-1H-pyrazol-3-amine?
The IUPAC name of 5-(4-fluoro-1H-benzimidazol-2-yl)-1H-pyrazol-3-amine (CID 135995632) is 5-(4-fluoro-1H-benzimidazol-2-yl)-1H-pyrazol-3-amine.
What is the SMILES notation for 5-(4-fluoro-1H-benzimidazol-2-yl)-1H-pyrazol-3-amine?
The canonical SMILES for 5-(4-fluoro-1H-benzimidazol-2-yl)-1H-pyrazol-3-amine is Nc1cc(-c2nc3c(F)cccc3[nH]2)[nH]n1.
What is the InChIKey of 5-(4-fluoro-1H-benzimidazol-2-yl)-1H-pyrazol-3-amine?
The InChIKey is GIRQRMAMDFIEBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8FN5/c11-5-2-1-3-6-9(5)14-10(13-6)7-4-8(12)16-15-7/h1-4H,(H,13,14)(H3,12,15,16).
What are the key properties of 5-(4-fluoro-1H-benzimidazol-2-yl)-1H-pyrazol-3-amine?
5-(4-fluoro-1H-benzimidazol-2-yl)-1H-pyrazol-3-amine has a molecular weight of 217.21 g/mol, XLogP of 1.67, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluoro-1H-benzimidazol-2-yl)-1H-pyrazol-3-amine is sourced from PubChem (CID 135995632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).