1-(difluoromethyl)-N-(furan-2-ylmethyl)pyrazol-3-amine

C9H9F2N3O — CID 122168918

IUPAC1-(difluoromethyl)-N-(furan-2-ylmethyl)pyrazol-3-amine
SMILESFC(F)n1ccc(NCc2ccco2)n1
InChIInChI=1S/C9H9F2N3O/c10-9(11)14-4-3-8(13-14)12-6-7-2-1-5-15-7/h1-5,9H,6H2,(H,12,13)
InChIKeyOBOQQQQABNZIBD-UHFFFAOYSA-N
MW213.19 g/mol
LogP2.48
Rot. Bonds4

About 1-(difluoromethyl)-N-(furan-2-ylmethyl)pyrazol-3-amine

1-(difluoromethyl)-N-(furan-2-ylmethyl)pyrazol-3-amine (PubChem CID 122168918) has the molecular formula C9H9F2N3O and a molecular weight of 213.19 g/mol. Its IUPAC name is 1-(difluoromethyl)-N-(furan-2-ylmethyl)pyrazol-3-amine.

Molecular Properties

Compound Name1-(difluoromethyl)-N-(furan-2-ylmethyl)pyrazol-3-amine
PubChem CID122168918
Molecular FormulaC9H9F2N3O
Molecular Weight213.19 g/mol
Exact Mass213.07
IUPAC Name1-(difluoromethyl)-N-(furan-2-ylmethyl)pyrazol-3-amine
SMILESFC(F)n1ccc(NCc2ccco2)n1
InChIInChI=1S/C9H9F2N3O/c10-9(11)14-4-3-8(13-14)12-6-7-2-1-5-15-7/h1-5,9H,6H2,(H,12,13)
InChIKeyOBOQQQQABNZIBD-UHFFFAOYSA-N
XLogP2.48
TPSA42.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.19
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(difluoromethyl)-N-(furan-2-ylmethyl)pyrazol-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(difluoromethyl)-N-[(2,3-difluorophenyl)methyl]pyrazol-3-amine;hydrochloride
CID 126966418
1-(difluoromethyl)-N-[(1,4-dimethylpyrazol-5-yl)methyl]pyrazol-3-amine;hydrochloride
CID 126964188
6-(3,5-dimethylpyrazol-1-yl)-N-(furan-2-ylmethyl)pyrimidin-4-amine
CID 53015130
N-(furan-2-ylmethyl)pyrimidin-2-amine
CID 28514232
3-(4-fluorophenyl)-N-(furan-2-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine
CID 126457174
5-bromo-N-(furan-2-ylmethyl)pyridin-2-amine
CID 28541636
2-ethyl-N-(furan-2-ylmethyl)-5-methylpyrazol-3-amine
CID 122168955
N-[(5-fluorothiophen-2-yl)methyl]-1-propan-2-ylpyrazol-3-amine;hydrochloride
CID 126966943
2-ethyl-N-(furan-2-ylmethyl)-6-hydrazinylpyrimidin-4-amine
CID 80937643
furan-2-ylmethylhydrazine;dihydrochloride
CID 53402165
N-(furan-2-ylmethyl)-3-pyrazol-1-ylaniline
CID 43739947
5-(furan-2-ylmethylamino)-1,3-dimethylpyrazole-4-carbonitrile
CID 63756975

Frequently Asked Questions

What is the IUPAC name of 1-(difluoromethyl)-N-(furan-2-ylmethyl)pyrazol-3-amine?
The IUPAC name of 1-(difluoromethyl)-N-(furan-2-ylmethyl)pyrazol-3-amine (CID 122168918) is 1-(difluoromethyl)-N-(furan-2-ylmethyl)pyrazol-3-amine.
What is the SMILES notation for 1-(difluoromethyl)-N-(furan-2-ylmethyl)pyrazol-3-amine?
The canonical SMILES for 1-(difluoromethyl)-N-(furan-2-ylmethyl)pyrazol-3-amine is FC(F)n1ccc(NCc2ccco2)n1.
What is the InChIKey of 1-(difluoromethyl)-N-(furan-2-ylmethyl)pyrazol-3-amine?
The InChIKey is OBOQQQQABNZIBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9F2N3O/c10-9(11)14-4-3-8(13-14)12-6-7-2-1-5-15-7/h1-5,9H,6H2,(H,12,13).
What are the key properties of 1-(difluoromethyl)-N-(furan-2-ylmethyl)pyrazol-3-amine?
1-(difluoromethyl)-N-(furan-2-ylmethyl)pyrazol-3-amine has a molecular weight of 213.19 g/mol, XLogP of 2.48, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(difluoromethyl)-N-(furan-2-ylmethyl)pyrazol-3-amine is sourced from PubChem (CID 122168918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).