2-amino-3-(3-fluorophenyl)-N',N'-dimethylpropanehydrazide

C11H16FN3O — CID 116849968

IUPAC2-amino-3-(3-fluorophenyl)-N',N'-dimethylpropanehydrazide
SMILESCN(C)NC(=O)C(N)Cc1cccc(F)c1
InChIInChI=1S/C11H16FN3O/c1-15(2)14-11(16)10(13)7-8-4-3-5-9(12)6-8/h3-6,10H,7,13H2,1-2H3,(H,14,16)
InChIKeyUZVPUNPGHIUUNC-UHFFFAOYSA-N
MW225.27 g/mol
LogP0.29
Rot. Bonds4

About 2-amino-3-(3-fluorophenyl)-N',N'-dimethylpropanehydrazide

2-amino-3-(3-fluorophenyl)-N',N'-dimethylpropanehydrazide (PubChem CID 116849968) has the molecular formula C11H16FN3O and a molecular weight of 225.27 g/mol. Its IUPAC name is 2-amino-3-(3-fluorophenyl)-N',N'-dimethylpropanehydrazide.

Molecular Properties

Compound Name2-amino-3-(3-fluorophenyl)-N',N'-dimethylpropanehydrazide
PubChem CID116849968
Molecular FormulaC11H16FN3O
Molecular Weight225.27 g/mol
Exact Mass225.13
IUPAC Name2-amino-3-(3-fluorophenyl)-N',N'-dimethylpropanehydrazide
SMILESCN(C)NC(=O)C(N)Cc1cccc(F)c1
InChIInChI=1S/C11H16FN3O/c1-15(2)14-11(16)10(13)7-8-4-3-5-9(12)6-8/h3-6,10H,7,13H2,1-2H3,(H,14,16)
InChIKeyUZVPUNPGHIUUNC-UHFFFAOYSA-N
XLogP0.29
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.27
LogP ≤ 50.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-amino-3-(3-fluorophenyl)-N',N'-dimethylpropanehydrazide 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

(2R)-2-amino-3-(3-fluorophenyl)propanamide
CID 102314592
2-amino-N',N'-dimethyl-3-naphthalen-2-ylpropanehydrazide
CID 116849985
propan-2-yl (2S)-2-amino-3-(3-fluorophenyl)propanoate
CID 67419664
(2S)-2-amino-N-[(3-fluorophenyl)methyl]-N-methyl-3-phenylpropanamide
CID 28802517
2-amino-N-[(3-fluorophenyl)methyl]-N-methyl-3-phenylpropanamide
CID 43211990
(2S)-2-[(2-amino-3-phenylpropanoyl)amino]-3-(3-fluorophenyl)propanoic acid
CID 135362369
(3R)-4-(3-fluorophenyl)-3-hydrazinylbutan-2-one
CID 139542071
(2S)-2-amino-N-(3-fluorophenyl)-3-phenylpropanamide
CID 22691298
(2S)-2-amino-N',N'-dimethyl-4-phenylbutanehydrazide
CID 104984735
(2R)-2-amino-3-(3-fluorophenyl)propanoic acid;(2R)-3-(3-fluorophenyl)-2-hydroxypropanoic acid
CID 158153122
2-amino-3-(3-fluorophenyl)propanoic acid;2,2,2-trifluoroacetic acid
CID 155543413
(Z,2S)-2-amino-1-(3-fluorophenyl)-4-methylhex-4-en-3-one;ethane;molecular hydrogen
CID 177211939

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-(3-fluorophenyl)-N',N'-dimethylpropanehydrazide?
The IUPAC name of 2-amino-3-(3-fluorophenyl)-N',N'-dimethylpropanehydrazide (CID 116849968) is 2-amino-3-(3-fluorophenyl)-N',N'-dimethylpropanehydrazide.
What is the SMILES notation for 2-amino-3-(3-fluorophenyl)-N',N'-dimethylpropanehydrazide?
The canonical SMILES for 2-amino-3-(3-fluorophenyl)-N',N'-dimethylpropanehydrazide is CN(C)NC(=O)C(N)Cc1cccc(F)c1.
What is the InChIKey of 2-amino-3-(3-fluorophenyl)-N',N'-dimethylpropanehydrazide?
The InChIKey is UZVPUNPGHIUUNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16FN3O/c1-15(2)14-11(16)10(13)7-8-4-3-5-9(12)6-8/h3-6,10H,7,13H2,1-2H3,(H,14,16).
What are the key properties of 2-amino-3-(3-fluorophenyl)-N',N'-dimethylpropanehydrazide?
2-amino-3-(3-fluorophenyl)-N',N'-dimethylpropanehydrazide has a molecular weight of 225.27 g/mol, XLogP of 0.29, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-(3-fluorophenyl)-N',N'-dimethylpropanehydrazide is sourced from PubChem (CID 116849968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).