2-(2,2-difluorocyclopropyl)pyrazol-3-amine;hydrochloride

C6H8ClF2N3 — CID 138046199

IUPAC2-(2,2-difluorocyclopropyl)pyrazol-3-amine;hydrochloride
SMILESCl.Nc1ccnn1C1CC1(F)F
InChIInChI=1S/C6H7F2N3.ClH/c7-6(8)3-4(6)11-5(9)1-2-10-11;/h1-2,4H,3,9H2;1H
InChIKeyOZTHAWQVOPVYAZ-UHFFFAOYSA-N
MW195.60 g/mol
LogP1.47
Rot. Bonds1

About 2-(2,2-difluorocyclopropyl)pyrazol-3-amine;hydrochloride

2-(2,2-difluorocyclopropyl)pyrazol-3-amine;hydrochloride (PubChem CID 138046199) has the molecular formula C6H8ClF2N3 and a molecular weight of 195.60 g/mol. Its IUPAC name is 2-(2,2-difluorocyclopropyl)pyrazol-3-amine;hydrochloride.

Molecular Properties

Compound Name2-(2,2-difluorocyclopropyl)pyrazol-3-amine;hydrochloride
PubChem CID138046199
Molecular FormulaC6H8ClF2N3
Molecular Weight195.60 g/mol
Exact Mass195.04
IUPAC Name2-(2,2-difluorocyclopropyl)pyrazol-3-amine;hydrochloride
SMILESCl.Nc1ccnn1C1CC1(F)F
InChIInChI=1S/C6H7F2N3.ClH/c7-6(8)3-4(6)11-5(9)1-2-10-11;/h1-2,4H,3,9H2;1H
InChIKeyOZTHAWQVOPVYAZ-UHFFFAOYSA-N
XLogP1.47
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.60
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-Methyl-2H-pyrazol-3-ylamine
CID 136927
1-Ethyl-1H-pyrazol-5-amine
CID 337310
1-(propan-2-yl)-1H-pyrazol-5-amine
CID 1090341
1-ethyl-1H-pyrazol-3-amine
CID 12198109
1-(butan-2-yl)-1H-pyrazol-5-amine
CID 3762483
1-(2-methylpropyl)-1H-pyrazol-5-amine
CID 4962021
1-Cyclohexyl-1H-pyrazol-5-amine
CID 77060
1-cyclopentyl-1H-pyrazol-5-amine
CID 1079792
1-(1-Cyclopropylethyl)-1H-pyrazol-5-amine
CID 3782762
1-(propan-2-yl)-1H-pyrazol-3-amine
CID 19576797
1-Butyl-1H-pyrazol-5-amine
CID 642216
1-Propyl-1H-pyrazol-5-amine
CID 1084923

Frequently Asked Questions

What is the IUPAC name of 2-(2,2-difluorocyclopropyl)pyrazol-3-amine;hydrochloride?
The IUPAC name of 2-(2,2-difluorocyclopropyl)pyrazol-3-amine;hydrochloride (CID 138046199) is 2-(2,2-difluorocyclopropyl)pyrazol-3-amine;hydrochloride.
What is the SMILES notation for 2-(2,2-difluorocyclopropyl)pyrazol-3-amine;hydrochloride?
The canonical SMILES for 2-(2,2-difluorocyclopropyl)pyrazol-3-amine;hydrochloride is Cl.Nc1ccnn1C1CC1(F)F.
What is the InChIKey of 2-(2,2-difluorocyclopropyl)pyrazol-3-amine;hydrochloride?
The InChIKey is OZTHAWQVOPVYAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7F2N3.ClH/c7-6(8)3-4(6)11-5(9)1-2-10-11;/h1-2,4H,3,9H2;1H.
What are the key properties of 2-(2,2-difluorocyclopropyl)pyrazol-3-amine;hydrochloride?
2-(2,2-difluorocyclopropyl)pyrazol-3-amine;hydrochloride has a molecular weight of 195.60 g/mol, XLogP of 1.47, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-difluorocyclopropyl)pyrazol-3-amine;hydrochloride is sourced from PubChem (CID 138046199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).