[1-(3-fluoro-4-pyridinyl)-2-methyl-2-methylsulfonylpropyl]hydrazine

C10H16FN3O2S — CID 105335480

IUPAC[1-(3-fluoro-4-pyridinyl)-2-methyl-2-methylsulfonylpropyl]hydrazine
SMILESCC(C)(C(NN)c1ccncc1F)S(C)(=O)=O
InChIInChI=1S/C10H16FN3O2S/c1-10(2,17(3,15)16)9(14-12)7-4-5-13-6-8(7)11/h4-6,9,14H,12H2,1-3H3
InChIKeyRIAULTMVRMECFI-UHFFFAOYSA-N
MW261.32 g/mol
LogP0.55
Rot. Bonds4

About [1-(3-fluoro-4-pyridinyl)-2-methyl-2-methylsulfonylpropyl]hydrazine

[1-(3-fluoro-4-pyridinyl)-2-methyl-2-methylsulfonylpropyl]hydrazine (PubChem CID 105335480) has the molecular formula C10H16FN3O2S and a molecular weight of 261.32 g/mol. Its IUPAC name is [1-(3-fluoro-4-pyridinyl)-2-methyl-2-methylsulfonylpropyl]hydrazine.

Molecular Properties

Compound Name[1-(3-fluoro-4-pyridinyl)-2-methyl-2-methylsulfonylpropyl]hydrazine
PubChem CID105335480
Molecular FormulaC10H16FN3O2S
Molecular Weight261.32 g/mol
Exact Mass261.09
IUPAC Name[1-(3-fluoro-4-pyridinyl)-2-methyl-2-methylsulfonylpropyl]hydrazine
SMILESCC(C)(C(NN)c1ccncc1F)S(C)(=O)=O
InChIInChI=1S/C10H16FN3O2S/c1-10(2,17(3,15)16)9(14-12)7-4-5-13-6-8(7)11/h4-6,9,14H,12H2,1-3H3
InChIKeyRIAULTMVRMECFI-UHFFFAOYSA-N
XLogP0.55
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-ethyl-1-(3-fluoro-4-pyridinyl)-2-methyl-2-methylsulfonylpropan-1-amine
CID 105038168
[(3-fluoro-4-pyridinyl)-(4-methyl-3-pyridinyl)methyl]hydrazine
CID 105258630
[1-(2,5-dichlorophenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine
CID 105302110
N,2-dimethyl-2-methylsulfonyl-1-[4-(trifluoromethyl)-3-pyridinyl]propan-1-amine
CID 102709667
[1-(4-bromo-3-chloro-2-fluorophenyl)-2-methyl-2-methylsulfonylpropyl]hydrazine
CID 106765598
[2-methyl-2-methylsulfonyl-1-(4-propan-2-ylphenyl)propyl]hydrazine
CID 105304336
1-(3-fluoro-4-pyridinyl)-2-methylsulfonylethanol
CID 115834015
[(3-fluoro-4-pyridinyl)-(2-methylfuran-3-yl)methyl]hydrazine
CID 105269064
[2,2-difluoro-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine
CID 105265116
[1-[4-fluoro-3-(trifluoromethyl)phenyl]-2-methyl-2-methylsulfonylpropyl]hydrazine
CID 107292604
1-N-ethyl-1-(3-fluoro-4-pyridinyl)-2-N,2-N,2-trimethylbutane-1,2-diamine
CID 104738429
[3,3,3-trifluoro-1-(3-fluoro-4-pyridinyl)propyl]hydrazine
CID 105206013

Frequently Asked Questions

What is the IUPAC name of [1-(3-fluoro-4-pyridinyl)-2-methyl-2-methylsulfonylpropyl]hydrazine?
The IUPAC name of [1-(3-fluoro-4-pyridinyl)-2-methyl-2-methylsulfonylpropyl]hydrazine (CID 105335480) is [1-(3-fluoro-4-pyridinyl)-2-methyl-2-methylsulfonylpropyl]hydrazine.
What is the SMILES notation for [1-(3-fluoro-4-pyridinyl)-2-methyl-2-methylsulfonylpropyl]hydrazine?
The canonical SMILES for [1-(3-fluoro-4-pyridinyl)-2-methyl-2-methylsulfonylpropyl]hydrazine is CC(C)(C(NN)c1ccncc1F)S(C)(=O)=O.
What is the InChIKey of [1-(3-fluoro-4-pyridinyl)-2-methyl-2-methylsulfonylpropyl]hydrazine?
The InChIKey is RIAULTMVRMECFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16FN3O2S/c1-10(2,17(3,15)16)9(14-12)7-4-5-13-6-8(7)11/h4-6,9,14H,12H2,1-3H3.
What are the key properties of [1-(3-fluoro-4-pyridinyl)-2-methyl-2-methylsulfonylpropyl]hydrazine?
[1-(3-fluoro-4-pyridinyl)-2-methyl-2-methylsulfonylpropyl]hydrazine has a molecular weight of 261.32 g/mol, XLogP of 0.55, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-fluoro-4-pyridinyl)-2-methyl-2-methylsulfonylpropyl]hydrazine is sourced from PubChem (CID 105335480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).