(3,5-dimethylpiperidin-1-yl)-(3-fluoro-2-hydrazinylphenyl)methanone

C14H20FN3O — CID 55100115

IUPAC(3,5-dimethylpiperidin-1-yl)-(3-fluoro-2-hydrazinylphenyl)methanone
SMILESCC1CC(C)CN(C(=O)c2cccc(F)c2NN)C1
InChIInChI=1S/C14H20FN3O/c1-9-6-10(2)8-18(7-9)14(19)11-4-3-5-12(15)13(11)17-16/h3-5,9-10,17H,6-8,16H2,1-2H3
InChIKeyGZKHKJPDTCMXKM-UHFFFAOYSA-N
MW265.33 g/mol
LogP2.23
Rot. Bonds2

About (3,5-dimethylpiperidin-1-yl)-(3-fluoro-2-hydrazinylphenyl)methanone

(3,5-dimethylpiperidin-1-yl)-(3-fluoro-2-hydrazinylphenyl)methanone (PubChem CID 55100115) has the molecular formula C14H20FN3O and a molecular weight of 265.33 g/mol. Its IUPAC name is (3,5-dimethylpiperidin-1-yl)-(3-fluoro-2-hydrazinylphenyl)methanone.

Molecular Properties

Compound Name(3,5-dimethylpiperidin-1-yl)-(3-fluoro-2-hydrazinylphenyl)methanone
PubChem CID55100115
Molecular FormulaC14H20FN3O
Molecular Weight265.33 g/mol
Exact Mass265.16
IUPAC Name(3,5-dimethylpiperidin-1-yl)-(3-fluoro-2-hydrazinylphenyl)methanone
SMILESCC1CC(C)CN(C(=O)c2cccc(F)c2NN)C1
InChIInChI=1S/C14H20FN3O/c1-9-6-10(2)8-18(7-9)14(19)11-4-3-5-12(15)13(11)17-16/h3-5,9-10,17H,6-8,16H2,1-2H3
InChIKeyGZKHKJPDTCMXKM-UHFFFAOYSA-N
XLogP2.23
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.33
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (3,5-dimethylpiperidin-1-yl)-(3-fluoro-2-hydrazinylphenyl)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

3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl-(3-fluoro-2-hydrazinylphenyl)methanone
CID 113336142
(3-fluoro-2-hydrazinylphenyl)-(2-methyl-1,4-oxazepan-4-yl)methanone
CID 62968377
(3-amino-5-methylpiperidin-1-yl)-(2,3-difluorophenyl)methanone
CID 79993492
(3-fluoro-2-hydrazinylphenyl)-(4-propan-2-ylpiperazin-1-yl)methanone
CID 62660994
(2,6-difluorophenyl)-[(3R,5S)-3,5-dimethylpiperidin-1-yl]methanone
CID 898638
1-(2,3-difluorobenzoyl)-5-methylpiperidine-3-carboxylic acid
CID 122118890
3,4-dihydro-1H-isoquinolin-2-yl-(3-fluoro-2-hydrazinylphenyl)methanone
CID 62661303
4-(3-fluoro-2-hydrazinylbenzoyl)morpholine-2-carbonitrile
CID 79675907
3-fluoro-2-hydrazinylbenzoic acid
CID 82007573
3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl-(3-fluoro-2-hydrazinylphenyl)methanone
CID 62659921
(3,4-dihydroxypyrrolidin-1-yl)-[3-fluoro-2-(propylamino)phenyl]methanone
CID 106673755
[3-(dimethylamino)-4-methylpyrrolidin-1-yl]-[3-fluoro-2-(methylamino)phenyl]methanone
CID 81475543

Frequently Asked Questions

What is the IUPAC name of (3,5-dimethylpiperidin-1-yl)-(3-fluoro-2-hydrazinylphenyl)methanone?
The IUPAC name of (3,5-dimethylpiperidin-1-yl)-(3-fluoro-2-hydrazinylphenyl)methanone (CID 55100115) is (3,5-dimethylpiperidin-1-yl)-(3-fluoro-2-hydrazinylphenyl)methanone.
What is the SMILES notation for (3,5-dimethylpiperidin-1-yl)-(3-fluoro-2-hydrazinylphenyl)methanone?
The canonical SMILES for (3,5-dimethylpiperidin-1-yl)-(3-fluoro-2-hydrazinylphenyl)methanone is CC1CC(C)CN(C(=O)c2cccc(F)c2NN)C1.
What is the InChIKey of (3,5-dimethylpiperidin-1-yl)-(3-fluoro-2-hydrazinylphenyl)methanone?
The InChIKey is GZKHKJPDTCMXKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FN3O/c1-9-6-10(2)8-18(7-9)14(19)11-4-3-5-12(15)13(11)17-16/h3-5,9-10,17H,6-8,16H2,1-2H3.
What are the key properties of (3,5-dimethylpiperidin-1-yl)-(3-fluoro-2-hydrazinylphenyl)methanone?
(3,5-dimethylpiperidin-1-yl)-(3-fluoro-2-hydrazinylphenyl)methanone has a molecular weight of 265.33 g/mol, XLogP of 2.23, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dimethylpiperidin-1-yl)-(3-fluoro-2-hydrazinylphenyl)methanone is sourced from PubChem (CID 55100115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).