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

C11H9FN4 — CID 137016959

IUPAC5-(4-fluoro-1H-indol-2-yl)-1H-pyrazol-4-amine
SMILESNc1cn[nH]c1-c1cc2c(F)cccc2[nH]1
InChIInChI=1S/C11H9FN4/c12-7-2-1-3-9-6(7)4-10(15-9)11-8(13)5-14-16-11/h1-5,15H,13H2,(H,14,16)
InChIKeyFKUDKKYZEMEWOW-UHFFFAOYSA-N
MW216.22 g/mol
LogP2.28
Rot. Bonds1

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

5-(4-fluoro-1H-indol-2-yl)-1H-pyrazol-4-amine (PubChem CID 137016959) has the molecular formula C11H9FN4 and a molecular weight of 216.22 g/mol. Its IUPAC name is 5-(4-fluoro-1H-indol-2-yl)-1H-pyrazol-4-amine.

Molecular Properties

Compound Name5-(4-fluoro-1H-indol-2-yl)-1H-pyrazol-4-amine
PubChem CID137016959
Molecular FormulaC11H9FN4
Molecular Weight216.22 g/mol
Exact Mass216.08
IUPAC Name5-(4-fluoro-1H-indol-2-yl)-1H-pyrazol-4-amine
SMILESNc1cn[nH]c1-c1cc2c(F)cccc2[nH]1
InChIInChI=1S/C11H9FN4/c12-7-2-1-3-9-6(7)4-10(15-9)11-8(13)5-14-16-11/h1-5,15H,13H2,(H,14,16)
InChIKeyFKUDKKYZEMEWOW-UHFFFAOYSA-N
XLogP2.28
TPSA70.49 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.22
LogP ≤ 52.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

5-(4-fluoro-1H-indol-2-yl)-1H-pyrazol-3-amine
CID 136985687
5-(4-fluoro-1-methylindol-2-yl)-1H-pyrazol-4-amine
CID 115004731
5-(4-fluoro-1H-indol-3-yl)-1H-pyrazol-4-amine
CID 136986362
4-fluoro-2-(6-methylpyrazin-2-yl)-1H-indole
CID 144766338
6-(4-fluoro-1H-indol-2-yl)-4-methyl-1H-pyridin-2-one
CID 144764054
2-(4-amino-1H-pyrazol-5-yl)-N,N-dimethyl-1H-benzimidazol-4-amine
CID 155678863
ethane;4-fluoro-2-methyl-1H-indole
CID 171088115
[5-(4-fluoro-1H-indol-2-yl)-1-methylpyrrol-2-yl]methanamine
CID 82386365
5-(4-methoxy-1H-indol-2-yl)-1H-pyrazole-4-carboxylic acid
CID 136986503
1H-indazol-4-amine;dihydrochloride
CID 18779330
4-fluoro-2-(2-propan-2-ylpyrimidin-4-yl)-1H-indole
CID 130177595
5-(4-bromo-1-benzothiophen-2-yl)-1H-pyrazol-4-amine
CID 115109736

Frequently Asked Questions

What is the IUPAC name of 5-(4-fluoro-1H-indol-2-yl)-1H-pyrazol-4-amine?
The IUPAC name of 5-(4-fluoro-1H-indol-2-yl)-1H-pyrazol-4-amine (CID 137016959) is 5-(4-fluoro-1H-indol-2-yl)-1H-pyrazol-4-amine.
What is the SMILES notation for 5-(4-fluoro-1H-indol-2-yl)-1H-pyrazol-4-amine?
The canonical SMILES for 5-(4-fluoro-1H-indol-2-yl)-1H-pyrazol-4-amine is Nc1cn[nH]c1-c1cc2c(F)cccc2[nH]1.
What is the InChIKey of 5-(4-fluoro-1H-indol-2-yl)-1H-pyrazol-4-amine?
The InChIKey is FKUDKKYZEMEWOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9FN4/c12-7-2-1-3-9-6(7)4-10(15-9)11-8(13)5-14-16-11/h1-5,15H,13H2,(H,14,16).
What are the key properties of 5-(4-fluoro-1H-indol-2-yl)-1H-pyrazol-4-amine?
5-(4-fluoro-1H-indol-2-yl)-1H-pyrazol-4-amine has a molecular weight of 216.22 g/mol, XLogP of 2.28, 1 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluoro-1H-indol-2-yl)-1H-pyrazol-4-amine is sourced from PubChem (CID 137016959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).