2-amino-2-(2,5-difluorophenyl)-N',N'-dimethylacetohydrazide

C10H13F2N3O — CID 116849798

IUPAC2-amino-2-(2,5-difluorophenyl)-N',N'-dimethylacetohydrazide
SMILESCN(C)NC(=O)C(N)c1cc(F)ccc1F
InChIInChI=1S/C10H13F2N3O/c1-15(2)14-10(16)9(13)7-5-6(11)3-4-8(7)12/h3-5,9H,13H2,1-2H3,(H,14,16)
InChIKeyMHEWJZSGKPZIFG-UHFFFAOYSA-N
MW229.23 g/mol
LogP0.56
Rot. Bonds3

About 2-amino-2-(2,5-difluorophenyl)-N',N'-dimethylacetohydrazide

2-amino-2-(2,5-difluorophenyl)-N',N'-dimethylacetohydrazide (PubChem CID 116849798) has the molecular formula C10H13F2N3O and a molecular weight of 229.23 g/mol. Its IUPAC name is 2-amino-2-(2,5-difluorophenyl)-N',N'-dimethylacetohydrazide.

Molecular Properties

Compound Name2-amino-2-(2,5-difluorophenyl)-N',N'-dimethylacetohydrazide
PubChem CID116849798
Molecular FormulaC10H13F2N3O
Molecular Weight229.23 g/mol
Exact Mass229.10
IUPAC Name2-amino-2-(2,5-difluorophenyl)-N',N'-dimethylacetohydrazide
SMILESCN(C)NC(=O)C(N)c1cc(F)ccc1F
InChIInChI=1S/C10H13F2N3O/c1-15(2)14-10(16)9(13)7-5-6(11)3-4-8(7)12/h3-5,9H,13H2,1-2H3,(H,14,16)
InChIKeyMHEWJZSGKPZIFG-UHFFFAOYSA-N
XLogP0.56
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.23
LogP ≤ 50.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-amino-2-(2,5-difluorophenyl)-N-methylacetohydrazide
CID 116848922
methyl (2S)-2-amino-2-(2,5-difluorophenyl)acetate
CID 51888842
(2R)-2-amino-2-(2,5-difluorophenyl)-N-(1,3-thiazol-2-yl)acetamide
CID 175993315
1-(2,5-difluorophenyl)-1-(dimethylamino)propan-2-one
CID 116859934
methyl 2-(2,5-difluorophenyl)propanoate
CID 62801922
2-amino-3-(3-fluorophenyl)-N',N'-dimethylpropanehydrazide
CID 116849968
2-(2,5-difluorophenyl)propanamide
CID 141213802
2-amino-3-(2,5-difluorophenyl)butanoic acid
CID 83909955
(2S)-2-amino-N-[1-(2,5-difluorophenyl)ethyl]butanamide
CID 79025345
1-(2,5-difluorophenyl)-1-N,1-N-dimethylpropane-1,2-diamine
CID 82284502
4-(2,5-difluorophenyl)-4-(dimethylamino)butanoic acid
CID 82386520
methyl (3R)-3-amino-3-(2,5-difluorophenyl)propanoate;hydrochloride
CID 171247795

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(2,5-difluorophenyl)-N',N'-dimethylacetohydrazide?
The IUPAC name of 2-amino-2-(2,5-difluorophenyl)-N',N'-dimethylacetohydrazide (CID 116849798) is 2-amino-2-(2,5-difluorophenyl)-N',N'-dimethylacetohydrazide.
What is the SMILES notation for 2-amino-2-(2,5-difluorophenyl)-N',N'-dimethylacetohydrazide?
The canonical SMILES for 2-amino-2-(2,5-difluorophenyl)-N',N'-dimethylacetohydrazide is CN(C)NC(=O)C(N)c1cc(F)ccc1F.
What is the InChIKey of 2-amino-2-(2,5-difluorophenyl)-N',N'-dimethylacetohydrazide?
The InChIKey is MHEWJZSGKPZIFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13F2N3O/c1-15(2)14-10(16)9(13)7-5-6(11)3-4-8(7)12/h3-5,9H,13H2,1-2H3,(H,14,16).
What are the key properties of 2-amino-2-(2,5-difluorophenyl)-N',N'-dimethylacetohydrazide?
2-amino-2-(2,5-difluorophenyl)-N',N'-dimethylacetohydrazide has a molecular weight of 229.23 g/mol, XLogP of 0.56, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(2,5-difluorophenyl)-N',N'-dimethylacetohydrazide is sourced from PubChem (CID 116849798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).