N'-(2,2-difluorocyclopropanecarbonyl)-2,2-dimethylcyclopropane-1-carbohydrazide

C10H14F2N2O2 — CID 90937535

IUPACN'-(2,2-difluorocyclopropanecarbonyl)-2,2-dimethylcyclopropane-1-carbohydrazide
SMILESCC1(C)CC1C(=O)NNC(=O)C1CC1(F)F
InChIInChI=1S/C10H14F2N2O2/c1-9(2)3-5(9)7(15)13-14-8(16)6-4-10(6,11)12/h5-6H,3-4H2,1-2H3,(H,13,15)(H,14,16)
InChIKeyNBHMDDMHMVFTSI-UHFFFAOYSA-N
MW232.23 g/mol
LogP0.84
Rot. Bonds2

About N'-(2,2-difluorocyclopropanecarbonyl)-2,2-dimethylcyclopropane-1-carbohydrazide

N'-(2,2-difluorocyclopropanecarbonyl)-2,2-dimethylcyclopropane-1-carbohydrazide (PubChem CID 90937535) has the molecular formula C10H14F2N2O2 and a molecular weight of 232.23 g/mol. Its IUPAC name is N'-(2,2-difluorocyclopropanecarbonyl)-2,2-dimethylcyclopropane-1-carbohydrazide.

Molecular Properties

Compound NameN'-(2,2-difluorocyclopropanecarbonyl)-2,2-dimethylcyclopropane-1-carbohydrazide
PubChem CID90937535
Molecular FormulaC10H14F2N2O2
Molecular Weight232.23 g/mol
Exact Mass232.10
IUPAC NameN'-(2,2-difluorocyclopropanecarbonyl)-2,2-dimethylcyclopropane-1-carbohydrazide
SMILESCC1(C)CC1C(=O)NNC(=O)C1CC1(F)F
InChIInChI=1S/C10H14F2N2O2/c1-9(2)3-5(9)7(15)13-14-8(16)6-4-10(6,11)12/h5-6H,3-4H2,1-2H3,(H,13,15)(H,14,16)
InChIKeyNBHMDDMHMVFTSI-UHFFFAOYSA-N
XLogP0.84
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.23
LogP ≤ 50.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N'-(2,2-difluorocyclopropanecarbonyl)-2,2-dimethylcyclopropane-1-carbohydrazide?
The IUPAC name of N'-(2,2-difluorocyclopropanecarbonyl)-2,2-dimethylcyclopropane-1-carbohydrazide (CID 90937535) is N'-(2,2-difluorocyclopropanecarbonyl)-2,2-dimethylcyclopropane-1-carbohydrazide.
What is the SMILES notation for N'-(2,2-difluorocyclopropanecarbonyl)-2,2-dimethylcyclopropane-1-carbohydrazide?
The canonical SMILES for N'-(2,2-difluorocyclopropanecarbonyl)-2,2-dimethylcyclopropane-1-carbohydrazide is CC1(C)CC1C(=O)NNC(=O)C1CC1(F)F.
What is the InChIKey of N'-(2,2-difluorocyclopropanecarbonyl)-2,2-dimethylcyclopropane-1-carbohydrazide?
The InChIKey is NBHMDDMHMVFTSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F2N2O2/c1-9(2)3-5(9)7(15)13-14-8(16)6-4-10(6,11)12/h5-6H,3-4H2,1-2H3,(H,13,15)(H,14,16).
What are the key properties of N'-(2,2-difluorocyclopropanecarbonyl)-2,2-dimethylcyclopropane-1-carbohydrazide?
N'-(2,2-difluorocyclopropanecarbonyl)-2,2-dimethylcyclopropane-1-carbohydrazide has a molecular weight of 232.23 g/mol, XLogP of 0.84, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2,2-difluorocyclopropanecarbonyl)-2,2-dimethylcyclopropane-1-carbohydrazide is sourced from PubChem (CID 90937535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).