N-(3,5-difluorophenyl)-1H-pyrazol-5-amine

C9H7F2N3 — CID 91409379

IUPACN-(3,5-difluorophenyl)-1H-pyrazol-5-amine
SMILESFc1cc(F)cc(Nc2ccn[nH]2)c1
InChIInChI=1S/C9H7F2N3/c10-6-3-7(11)5-8(4-6)13-9-1-2-12-14-9/h1-5H,(H2,12,13,14)
InChIKeyGBXCOWGWOCAIOA-UHFFFAOYSA-N
MW195.17 g/mol
LogP2.43
Rot. Bonds2

About N-(3,5-difluorophenyl)-1H-pyrazol-5-amine

N-(3,5-difluorophenyl)-1H-pyrazol-5-amine (PubChem CID 91409379) has the molecular formula C9H7F2N3 and a molecular weight of 195.17 g/mol. Its IUPAC name is N-(3,5-difluorophenyl)-1H-pyrazol-5-amine.

Molecular Properties

Compound NameN-(3,5-difluorophenyl)-1H-pyrazol-5-amine
PubChem CID91409379
Molecular FormulaC9H7F2N3
Molecular Weight195.17 g/mol
Exact Mass195.06
IUPAC NameN-(3,5-difluorophenyl)-1H-pyrazol-5-amine
SMILESFc1cc(F)cc(Nc2ccn[nH]2)c1
InChIInChI=1S/C9H7F2N3/c10-6-3-7(11)5-8(4-6)13-9-1-2-12-14-9/h1-5H,(H2,12,13,14)
InChIKeyGBXCOWGWOCAIOA-UHFFFAOYSA-N
XLogP2.43
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.17
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3,5-difluorophenyl)-1H-pyrazol-5-amine?
The IUPAC name of N-(3,5-difluorophenyl)-1H-pyrazol-5-amine (CID 91409379) is N-(3,5-difluorophenyl)-1H-pyrazol-5-amine.
What is the SMILES notation for N-(3,5-difluorophenyl)-1H-pyrazol-5-amine?
The canonical SMILES for N-(3,5-difluorophenyl)-1H-pyrazol-5-amine is Fc1cc(F)cc(Nc2ccn[nH]2)c1.
What is the InChIKey of N-(3,5-difluorophenyl)-1H-pyrazol-5-amine?
The InChIKey is GBXCOWGWOCAIOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7F2N3/c10-6-3-7(11)5-8(4-6)13-9-1-2-12-14-9/h1-5H,(H2,12,13,14).
What are the key properties of N-(3,5-difluorophenyl)-1H-pyrazol-5-amine?
N-(3,5-difluorophenyl)-1H-pyrazol-5-amine has a molecular weight of 195.17 g/mol, XLogP of 2.43, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-difluorophenyl)-1H-pyrazol-5-amine is sourced from PubChem (CID 91409379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).