2,2-difluoro-3-morpholin-4-ylpropanehydrazide

C7H13F2N3O2 — CID 165463829

IUPAC2,2-difluoro-3-morpholin-4-ylpropanehydrazide
SMILESNNC(=O)C(F)(F)CN1CCOCC1
InChIInChI=1S/C7H13F2N3O2/c8-7(9,6(13)11-10)5-12-1-3-14-4-2-12/h1-5,10H2,(H,11,13)
InChIKeyAKGMYUYRVKYTRQ-UHFFFAOYSA-N
MW209.20 g/mol
LogP-1.06
Rot. Bonds3

About 2,2-difluoro-3-morpholin-4-ylpropanehydrazide

2,2-difluoro-3-morpholin-4-ylpropanehydrazide (PubChem CID 165463829) has the molecular formula C7H13F2N3O2 and a molecular weight of 209.20 g/mol. Its IUPAC name is 2,2-difluoro-3-morpholin-4-ylpropanehydrazide.

Molecular Properties

Compound Name2,2-difluoro-3-morpholin-4-ylpropanehydrazide
PubChem CID165463829
Molecular FormulaC7H13F2N3O2
Molecular Weight209.20 g/mol
Exact Mass209.10
IUPAC Name2,2-difluoro-3-morpholin-4-ylpropanehydrazide
SMILESNNC(=O)C(F)(F)CN1CCOCC1
InChIInChI=1S/C7H13F2N3O2/c8-7(9,6(13)11-10)5-12-1-3-14-4-2-12/h1-5,10H2,(H,11,13)
InChIKeyAKGMYUYRVKYTRQ-UHFFFAOYSA-N
XLogP-1.06
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.20
LogP ≤ 5-1.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2,2-difluoro-3-(2-methylazetidin-1-yl)propanehydrazide
CID 165466537
2-morpholin-4-ylacetamide;2,2,2-trifluoroacetic acid
CID 68772351
5-morpholin-4-ylpentanehydrazide
CID 63570305
4-(2,2,3,3-tetrafluoropropyl)morpholine
CID 12554036
3-amino-2,2-difluoro-1-morpholin-4-ylpropan-1-one
CID 130600801
N,N-bis(2,2-dimethyl-3-morpholin-4-ylpropyl)acetamide
CID 100937943
potassium 2,2-dimethyl-3-morpholin-4-ylpropanoate
CID 68757651
2-morpholin-4-ylethylhydrazine;oxalic acid
CID 46741446
2-morpholin-4-ylethyl 3,3,3-trifluoropropanoate
CID 166930136
methyl 3,3-dimethyl-2-(morpholin-4-ylmethyl)butanoate
CID 117242468
1,3-dimorpholin-4-ylpropan-2-one
CID 139559066
3-[2-morpholin-4-ylethyl-(2,2,2-trifluoroacetyl)amino]propanoic acid
CID 82325840

Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-3-morpholin-4-ylpropanehydrazide?
The IUPAC name of 2,2-difluoro-3-morpholin-4-ylpropanehydrazide (CID 165463829) is 2,2-difluoro-3-morpholin-4-ylpropanehydrazide.
What is the SMILES notation for 2,2-difluoro-3-morpholin-4-ylpropanehydrazide?
The canonical SMILES for 2,2-difluoro-3-morpholin-4-ylpropanehydrazide is NNC(=O)C(F)(F)CN1CCOCC1.
What is the InChIKey of 2,2-difluoro-3-morpholin-4-ylpropanehydrazide?
The InChIKey is AKGMYUYRVKYTRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13F2N3O2/c8-7(9,6(13)11-10)5-12-1-3-14-4-2-12/h1-5,10H2,(H,11,13).
What are the key properties of 2,2-difluoro-3-morpholin-4-ylpropanehydrazide?
2,2-difluoro-3-morpholin-4-ylpropanehydrazide has a molecular weight of 209.20 g/mol, XLogP of -1.06, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-3-morpholin-4-ylpropanehydrazide is sourced from PubChem (CID 165463829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).