[5-(difluoromethyl)-3-(difluoromethylidene)-5-hydroxypyrazolidin-1-yl]-(furan-2-yl)methanone

C10H8F4N2O3 — CID 4744823

IUPAC[5-(difluoromethyl)-3-(difluoromethylidene)-5-hydroxypyrazolidin-1-yl]-(furan-2-yl)methanone
SMILESO=C(c1ccco1)N1NC(=C(F)F)CC1(O)C(F)F
InChIInChI=1S/C10H8F4N2O3/c11-7(12)5-4-10(18,9(13)14)16(15-5)8(17)6-2-1-3-19-6/h1-3,9,15,18H,4H2
InChIKeyVHFPBSDIWCUGOO-UHFFFAOYSA-N
MW280.18 g/mol
LogP1.69
Rot. Bonds2

About [5-(difluoromethyl)-3-(difluoromethylidene)-5-hydroxypyrazolidin-1-yl]-(furan-2-yl)methanone

[5-(difluoromethyl)-3-(difluoromethylidene)-5-hydroxypyrazolidin-1-yl]-(furan-2-yl)methanone (PubChem CID 4744823) has the molecular formula C10H8F4N2O3 and a molecular weight of 280.18 g/mol. Its IUPAC name is [5-(difluoromethyl)-3-(difluoromethylidene)-5-hydroxypyrazolidin-1-yl]-(furan-2-yl)methanone.

Molecular Properties

Compound Name[5-(difluoromethyl)-3-(difluoromethylidene)-5-hydroxypyrazolidin-1-yl]-(furan-2-yl)methanone
PubChem CID4744823
Molecular FormulaC10H8F4N2O3
Molecular Weight280.18 g/mol
Exact Mass280.05
IUPAC Name[5-(difluoromethyl)-3-(difluoromethylidene)-5-hydroxypyrazolidin-1-yl]-(furan-2-yl)methanone
SMILESO=C(c1ccco1)N1NC(=C(F)F)CC1(O)C(F)F
InChIInChI=1S/C10H8F4N2O3/c11-7(12)5-4-10(18,9(13)14)16(15-5)8(17)6-2-1-3-19-6/h1-3,9,15,18H,4H2
InChIKeyVHFPBSDIWCUGOO-UHFFFAOYSA-N
XLogP1.69
TPSA65.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.18
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze [5-(difluoromethyl)-3-(difluoromethylidene)-5-hydroxypyrazolidin-1-yl]-(furan-2-yl)methanone 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

[(5R)-3,5-bis(difluoromethyl)-5-hydroxy-4H-pyrazol-1-yl]-(furan-2-yl)methanone
CID 842848
[5-(difluoromethyl)-3-(difluoromethylidene)-5-hydroxypyrazolidin-1-yl]-[2-(2,4-dimethylphenyl)quinolin-4-yl]methanone
CID 4748601
[3-[(4-chlorophenoxy)methyl]-4-methoxyphenyl]-[5-(difluoromethyl)-3-(difluoromethylidene)-5-hydroxypyrazolidin-1-yl]methanone
CID 4748365
(4-cyclopropylidenepiperidin-1-yl)-(furan-2-yl)methanone
CID 121184150
azepan-1-yl(furan-2-yl)methanone
CID 5200992
(3,5-dimethylpiperidin-1-yl)-(furan-2-yl)methanone
CID 3554553
[(3R,5R)-3,5-dimethylpiperidin-1-yl]-(furan-2-yl)methanone
CID 669413
furan-2-yl-(2-methylaziridin-1-yl)methanone
CID 71425455
[4-(difluoromethylsulfanyl)phenyl]-[4-(furan-2-carbonyl)piperazin-1-yl]methanone
CID 42093720
furan-2-yl-[4-(1-hydroxycyclopentanecarbonyl)piperazin-1-yl]methanone
CID 110906971
[4-[4-(difluoromethylsulfonyl)phenyl]piperazin-1-yl]-(furan-2-yl)methanone
CID 55823789
(2,6-dimethylpiperazin-1-yl)-(furan-2-yl)methanone
CID 63911769

Frequently Asked Questions

What is the IUPAC name of [5-(difluoromethyl)-3-(difluoromethylidene)-5-hydroxypyrazolidin-1-yl]-(furan-2-yl)methanone?
The IUPAC name of [5-(difluoromethyl)-3-(difluoromethylidene)-5-hydroxypyrazolidin-1-yl]-(furan-2-yl)methanone (CID 4744823) is [5-(difluoromethyl)-3-(difluoromethylidene)-5-hydroxypyrazolidin-1-yl]-(furan-2-yl)methanone.
What is the SMILES notation for [5-(difluoromethyl)-3-(difluoromethylidene)-5-hydroxypyrazolidin-1-yl]-(furan-2-yl)methanone?
The canonical SMILES for [5-(difluoromethyl)-3-(difluoromethylidene)-5-hydroxypyrazolidin-1-yl]-(furan-2-yl)methanone is O=C(c1ccco1)N1NC(=C(F)F)CC1(O)C(F)F.
What is the InChIKey of [5-(difluoromethyl)-3-(difluoromethylidene)-5-hydroxypyrazolidin-1-yl]-(furan-2-yl)methanone?
The InChIKey is VHFPBSDIWCUGOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8F4N2O3/c11-7(12)5-4-10(18,9(13)14)16(15-5)8(17)6-2-1-3-19-6/h1-3,9,15,18H,4H2.
What are the key properties of [5-(difluoromethyl)-3-(difluoromethylidene)-5-hydroxypyrazolidin-1-yl]-(furan-2-yl)methanone?
[5-(difluoromethyl)-3-(difluoromethylidene)-5-hydroxypyrazolidin-1-yl]-(furan-2-yl)methanone has a molecular weight of 280.18 g/mol, XLogP of 1.69, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(difluoromethyl)-3-(difluoromethylidene)-5-hydroxypyrazolidin-1-yl]-(furan-2-yl)methanone is sourced from PubChem (CID 4744823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).